(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
2
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
3
|
Cn1c2c(cn1)c(ncn2)Sc3nnc(o3)c4cccnc4
|
|
4
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
5
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
6
|
c1ccc(cc1)[C@@]2(CCn3c4c2cccc4nn3)O
|
|
7
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
8
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
9
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
10
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
11
|
c1ccc(cc1)c2ncc(cn2)OC(=O)Cc3ccccc3F
|
|
12
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
13
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
14
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
15
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
16
|
|
|
17
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
18
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
19
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
20
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
21
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
22
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
23
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
24
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
25
|
CN(C)c1ccc(cc1)[C@@H]2NC[C@@H](O2)CSc3ccccn3
|
|
26
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
27
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
28
|
CCc1nnc(o1)COC(=O)cc([n-]s/c2=NC)C
|
|
29
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
30
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
31
|
CC(C)(C)OC(=O)N1CCc2c(ncnc2Cl)CC1
|
|
32
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
33
|
Cc1cc2c(n[nH]c(=O)c2c(=O)[nH]1)Cc3ccco3
|
|
34
|
CC1C(N2C(NCN2)NN1)N(C)C3CCCCC3
|
|
35
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
36
|
c1ccnc(c1)c2cn(nn2)C3CCN(CC3)C(=O)C4CC4
|
|
37
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
38
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
39
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
40
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
41
|
Cn1c2ccccc2n3c1n[nH]c3=O
|
|
42
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
43
|
CC1CCC(CC1)S(=O)(=O)N2CCN3C2C(CN3)C#N
|
|
44
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
45
|
|
|
46
|
c1ccc(cc1)NC(=O)/C=c/2c(nc3n2c4ccccc4n3)O
|
|
47
|
C[C@@H](Cn1cc(cn1)Cl)c2cc(=O)[nH]c(n2)NC(C)C
|
|
48
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
49
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
50
|
CC1=NN=C2[C@H]1C(=c3ccccc3=[NH+]2)Oc4ccc(cc4)OC
|
|
51
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
52
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
53
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
54
|
c1ccc2c(c1)CN(c3cccnc3O2)c4ccc(s4)C(=O)[O-]
|
|
55
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
56
|
c1ccc(cc1)c2c(cno2)c3nnnn3c4ccccc4
|
|
57
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
58
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
59
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
60
|
c1ccc(cc1)CN2Cc3c(=O)c4ccccc4sc3NC2
|
|
61
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
62
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
63
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
64
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
65
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
66
|
c1ccc(cc1)n2ccc(n2)Nc3nccc(n3)C(F)(F)F
|
|
67
|
c1ccc2c(c1)C[C@@H]3C(=O)N=C(N3C2)Nc4ccccc4F
|
|
68
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
69
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
70
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
71
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
72
|
Cn1c(=O)c(c(cn1)SCc2ccco2)Cl
|
|
73
|
CCS(=O)(=O)c1ccc(s1)c2cccc(c2)c3cc[nH]n3
|
|
74
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
75
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
76
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
77
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
78
|
c1c2c(nc(n1)N)CCCC2=O
|
|
79
|
CN(C)c1c2c(ncn1)Sc3c(c(ncn3)OC)C=N2
|
|
80
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
81
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
82
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
83
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
84
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
85
|
|
|
86
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
87
|
c1cnc(nc1)SCc2cc(=O)c(co2)O
|
|
88
|
Cn1c(cc(n1)c2ccccc(=O)c2[O-])C(=O)[O-]
|
|
89
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
90
|
COC(=O)C1=CNN2C1=NCN(C2)Cc3ccccc3
|
|
91
|
c1ccc(cc1)/C=C/Cn2c(=O)c3c(cccn3)oc2=O
|
|
92
|
CCCCC1=N[C@@H]2[C@@H](c3c(c(ncn3)OC)S2)C4=C1CCC4
|
|
93
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
94
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
95
|
Cc1nnc(s1)Sc2cc(nc(n2)N)Cl
|
|
96
|
c1cnnc(n1)c2nccnn2
|
|
97
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
98
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
99
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
100
|
c1cc(cnc1)c2nnc(s2)Cc3cccs3
|
|
101
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
102
|
|
|
103
|
CCCCN1CCS(=O)(=O)c2c1c(nc(c2F)F)F
|
|
104
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
105
|
c1ccc2c(c1)nnn2CC#C[C@@H](c3ccco3)O
|
|
106
|
c1ccc2c(c1)c(cc(=O)o2)Sc3ccccn3
|
|
107
|
Cc1nnc(s1)Sc2cc(=O)oc3c2cccc3
|
|
108
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
109
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
110
|
CCc1n[n-]/c(=N/C(=O)c2c(c(c(c(c2F)F)F)F)F)/s1
|
|
111
|
Cc1c(cc(o1)C(=O)[O-])Sc2ccccc2C(=O)[O-]
|
|
112
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
113
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
114
|
Cc1c(non1)NCNc2c(non2)C
|
|
115
|
CCOc1c(c([nH]n1)N)C#N
|
|
116
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
117
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
118
|
c1ccc(c(c1)N)Nc2c(cn(c(=O)n2)Cc3cccs3)C#N
|
|
119
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
120
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
121
|
CCCSc1[n-]s/c(=N/C(=O)CN2CCCC2)/n1
|
|
122
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
123
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
124
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
125
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
126
|
c1ccc2c(c1)C(=O)c3cccc4c3C2=NNS4(=O)=O
|
|
127
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
128
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
129
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
130
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
131
|
C=C1c2ccccc2C=Cc3c1cccc3
|
|
132
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
133
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
134
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
135
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
136
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
137
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
138
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)[nH]n2
|
|
139
|
c1ccc-2c(c1)CSc3c2[nH]nc3O
|
|
140
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
141
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
142
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
143
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
144
|
|
|
145
|
CC1CC(N(N1)C(=O)C2CNN3C2N(CCC3=O)C(C)C)C
|
|
146
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
147
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
148
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2[nH]nc3
|
|
149
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Nc3ccc4c(c3)OCO4
|
|
150
|
C[C@@H]1C=CN(c2n1ncc2C(=O)[O-])C
|
|
151
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
152
|
Cc1ccc(cc1)[N-]C2=NS(=O)(=O)c3cc(ccc3S2)F
|
|
153
|
c1ccc-2c(c1)CN[C@@H](c3n2ccc3)c4ccc(cc4)F
|
|
154
|
CCCCN1CCc2cccc(c2SC1)C
|
|
155
|
c1cc(sc1)C2=COC3(C2)CCN(CC3)C(=O)c4cnccn4
|
|
156
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
157
|
c1ccc(cc1)c2cc3c(nc2)CCc4c(cccc4C#N)C3
|
|
158
|
CCSc1nnc(n1C)CSc2c([nH]c3c2cccc3)C
|
|
159
|
Cc1c(nn(c(=O)c1C#N)Cc2nc3ccccc3o2)C
|
|
160
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
161
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
162
|
c1cc(sc1)C(=O)c2cnc3n2cccn3
|
|
163
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
164
|
C1CCC(CC1)C(=O)/C(=C/2NN=C3N2CCCCC3)/C#N
|
|
165
|
c1ccc2c(c1)cc(c(=O)o2)C(=O)n3cccn3
|
|
166
|
COc1ccc(cc1)C(=O)Oc2cc(n(n2)S(=O)(=O)C)N
|
|
167
|
CC1CC(N2C1[C@@H](CC2)O)C3(C(=O)C4CCCCC4C3=O)O
|
|
168
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2nc(s3)C
|
|
169
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
170
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
171
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
172
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
173
|
Cc1c2ccn(c(=O)c2n(n1)C)CC(=O)NC3CC3
|
|
174
|
c1ccc2c(c1)-n3c(n[nH]c3=O)CS2
|
|
175
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
176
|
c1ccnc(c1)[C@@H]2Nc3c(c4c(s3)CCCC4)C(=O)N2
|
|
177
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
178
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
179
|
CC1(/C(=C(Nc2ccccn2)/O)/C(=O)c3ccccc3S1)C
|
|
180
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
181
|
CN1C2CCCCC2S(=O)(=O)N3C1NNC3CC4CCCCC4
|
|
182
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
183
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
184
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
185
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
186
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
187
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
188
|
CCN1CCC2C1NCNC2N
|
|
189
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
190
|
CCN1c2cscc2S(=O)(=O)N(C1=O)Cc3ccccn3
|
|
191
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
192
|
CC(C)(C)OC(=O)N[C@@H](CC#Cc1ccccc1)C(=O)OC
|
|
193
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
194
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
195
|
|
|
196
|
c1ccc2c(c1)OCc3cc(ccc3O2)N
|
|
197
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
198
|
Cc1c(sc(n1)c2c(n(nn2)c3ccccc3)C)C(=O)[O-]
|
|
199
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
200
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
201
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
202
|
Cn1c(=O)c2c3c(c[nH]n3)oc2n(c1=O)C
|
|
203
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
204
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
205
|
c1ccc2c(c1)ccn2Cc3cnc(s3)Cl
|
|
206
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
207
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
208
|
Cc1cc(c(c(c1)C)OS(=O)(=O)Nc2cccnc2)C
|
|
209
|
c1ccnc(c1)C#CCN2CCCCC2
|
|
210
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
211
|
C1CCC(CC1)NN2CNC3C2C4CCCCC4CC3
|
|
212
|
Cc1csc(=O)n1CCC(=O)[C@@H](C#N)c2ccccn2
|
|
213
|
Cn1c-2n/c(=NCc3ccccc3)/n(c2c([nH]c1=O)[O-])CC(=O)[O-]
|
|
214
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
215
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
216
|
Cc1ccc(cc1)S/C=C/c3ccccc3C(=O)N2
|
|
217
|
Cc1cc(no1)Cn2cnc3ccccc3c2=O
|
|
218
|
c1ccc(cc1)S(=O)(=O)N2C=Cc3ccccc3[C@@H]2C#N
|
|
219
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
220
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
221
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
222
|
c1ccc2c(c1)nc(c3n2nnn3)N
|
|
223
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
224
|
c1ccc2c(c1)C3=NC(=N[C@H]3C2=O)C(=O)c4ccccc4C(=O)[O-]
|
|
225
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
226
|
Cc1cc(n(n1)CCc2nc(on2)c3ccccc3)C
|
|
227
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
228
|
c1ccc2c(c1)c(=O)n(nn2)Cn3cnc(n3)C#N
|
|
229
|
CC(C)(C)C1NNNN1CN2CCN(CC2)S(=O)(=O)C
|
|
230
|
Cc1c(ccnc1COc2nc3ccccc3o2)OCC(C)C
|
|
231
|
c1ccc2c(c1)CCN3[C@@H]2Cc4c(cno4)C3=O
|
|
232
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
233
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
234
|
c1ccc2c(c1)ccn2Cc3nnc(s3)Cc4cccs4
|
|
235
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
236
|
c1ccc2c(c1)nnn2CN3CSc4c3cccc4
|
|
237
|
|
|
238
|
C1CCC2C(C1)CC3CCCC4C3[C@@H]2N=C4
|
|
239
|
CCCCc1cn(nn1)CC2CCN(CC2)C(=O)C
|
|
240
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
241
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
242
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
243
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
244
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
245
|
c1nc(c(n1Cc2n[n-]nn2)Cl)Cl
|
|
246
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
247
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
248
|
c1ccc2c(c1)c(=O)cc(o2)c3cc(cc4c3OCOC4)Cl
|
|
249
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
250
|
c1ccc2c(c1)[C@H]3C[C@@H]([C@@H]2N3)c4ccc(nc4)Cl
|
|
251
|
c1cc(ccc1OC=CNN/C2=C/3C=CC(=O)C=C3[O-])F
|
|
252
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
253
|
CCC(CC)Nc1c(nc(c(n1)C)Oc2cc(ccn2)C)C
|
|
254
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
255
|
c1ccc2c(c1)CC3=C(C=C2)C(=O)OC3
|
|
256
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
257
|
c1cnn(c1)c2ccc(cc2c3nnc4n3ccnc4)F
|
|
258
|
Cc1ccn(n1)CC/N=C/[C@@H](C(=O)C2=O)NCCCOC
|
|
259
|
C1CCC(CC1)C2NNC(O2)C3C4CCCCC4SN3
|
|
260
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
261
|
C/C=C/C=C/C1CC2CC3C(C(C2C(=O)[NH]1)O)CCC3
|
|
262
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
263
|
CCOC(=O)c1c2n(cn1)-c3ccc(cc3C(=O)N(C2)C)F
|
|
264
|
c1c(cn[nH]c1=O)N2CCCC2
|
|
265
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
266
|
CN(C)/C=C/C(=O)N=C(S1)/C=C(/c2cccs2)[O-]
|
|
267
|
c1ccc(cc1)n2cnc3c2cncn3
|
|
268
|
C[C@@H]1C#CC[C@@H](/C=C/CCCCC1=O)OCOC
|
|
269
|
c1ccc(cc1)NC(=O)[C@@H]2Cc3c2cccc3
|
|
270
|
c1ccc(cc1)CN2CCc3c(c4cccc5c4n3CC(=O)N5)C2
|
|
271
|
c1cnc(cn1)NC23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
272
|
c1nncn1NC(=O)CC#N
|
|
273
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
274
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
275
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
276
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
277
|
COC(=O)c1c(cc(s1)c2cc(no2)c3ccccc3)N
|
|
278
|
C[C@@H]1c2cccn2CCN1c3c4cn[nH]c4nc(n3)N
|
|
279
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
280
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
281
|
C[C@@H](c1nc2ccccc2o1)n3c4ccccc4nn3
|
|
282
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
283
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
284
|
Cc1cc2ccccc2n1Cc3nnc(s3)c4ccccc4
|
|
285
|
Cc1ccc(cc1)Sc2c(cccn2)n3cccc3
|
|
286
|
CC1NNC2N1-C3CCCCC3-C4C(C5CCCCC5[NH]4)C2
|
|
287
|
Cc1cccn2c1nc(c2c3nnc(n3C)SCC=C)C
|
|
288
|
COc1ccc(cc1OC2CCCC2)c3ccc(nc3)C(=O)N
|
|
289
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
290
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
291
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
292
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
293
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
294
|
CC(C)(C)OC(=O)N1CCC(=CC1)C#Cc2ccccn2
|
|
295
|
C[C@@H]1c2nc3ccccc3n2CN(CO1)c4ccc(cc4)F
|
|
296
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
297
|
|
|
298
|
|
|
299
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
300
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
301
|
COC(=O)[C@@H]1CC/C(=C(C#N)/C2=N[C@@H](CC2)C(=O)OC)/N1
|
|
302
|
Cc1cc(no1)CSc2nc(c(o2)C)C
|
|
303
|
Cc1nc(on1)CNS(=O)(=O)C
|
|
304
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
305
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
306
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
307
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
308
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
309
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
310
|
c1ccc2c(c1)N(CCS2)c3ccc(s3)C(=O)[O-]
|
|
311
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
312
|
c1cc(oc1)CSc2ccc(cc2)n3cnnn3
|
|
313
|
C[C@@]1(c2cccn2-c3ccccc3CO1)C(=O)[O-]
|
|
314
|
COc1ccc(cc1)/N=c/c3ccccc3[nH]c(=O)cn2
|
|
315
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
316
|
Cc1ccc(cc1)S(=O)(=O)N2CCN=C(C=C2)C(F)(F)F
|
|
317
|
c1cocc1c2nc([nH]n2)N
|
|
318
|
COC(=O)Oc1c(c2c(s1)nc3ccccc3n2)N
|
|
319
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
320
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
321
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
322
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
323
|
c1cnc(c(n1)C#N)NCc2nc3c(s2)CCCC3
|
|
324
|
|
|
325
|
c1ccc2c(c1)c3c(c(=O)o2)C=Nc4ccccc4N3
|
|
326
|
CCOCc1cn(c(nc1=[NH2+])C)CC(=O)c2ccccc2
|
|
327
|
CNc1ccccc1[C@@H]2C=CC(=C2)c3ccccc3
|
|
328
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
329
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
330
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
331
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
332
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
333
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
334
|
c1cc(cnc1)CNCCc2ccco2
|
|
335
|
|
|
336
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
337
|
c1ccc2c(c1)Cc3c(ccs3)C=C2
|
|
338
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
339
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
340
|
Cc1c2nc3ccccc3n2c(=O)[nH]n1
|
|
341
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
342
|
Cc1cc(nc(n1)Sc2nc(nc(n2)Cl)NC)C
|
|
343
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
344
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
345
|
C1C(C(C2C(C1F)N[NH]N2)N)F
|
|
346
|
|
|
347
|
COc1ccc(cc1)C2=COc3ccccc3C(=O)N2
|
|
348
|
CCOC(=O)c1c(c([nH]c1C)c2cn3ccccc3n2)C
|
|
349
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
350
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
351
|
c1csc2c1C(=O)N[C@@H]3CCCCN3C2
|
|
352
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
353
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
354
|
c1ccc2c(c1)nc3n2CN=C4N3CN(CN4)CCO
|
|
355
|
c1ccc2c(c1)ccc3c2CCc4c(c(co4)C(=O)N)C3=O
|
|
356
|
c1cc(ccc1Oc2c(c3n(c(=O)c2Cl)CCS3)F)F
|
|
357
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
358
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
359
|
|
|
360
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
361
|
Cc1ccsc1C(=O)N[C@@H]2CCc3c(cnc(n3)C)C2
|
|
362
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
363
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
364
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
365
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
366
|
CN1CNC(=O)c2c1n[nH]n2
|
|
367
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
368
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
369
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
370
|
Cn1c(nnc1Sc2cnccn2)c3ccc(cc3)F
|
|
371
|
CC1C(SC(N1)C[C@@H](C)N2CC(CN2)CL)C(=O)C
|
|
372
|
COc1ccc(cc1)/C=C/c2nc3c(o2)C=CCC3
|
|
373
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
374
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
375
|
Cc1nn(c(=O)c2n1ccn2)CC(=O)OC
|
|
376
|
|
|
377
|
CN1CCn2ccc3c2c1nc(=O)[nH]3
|
|
378
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
379
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
380
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
381
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
382
|
Cc1cc(=O)c2c(o1)cc3c(c2O)CC=C(CO3)C
|
|
383
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
384
|
CSc1nc2c(cc(s2)c3ccccc3)nn1
|
|
385
|
Cn1cnc2c1ccnc2C(=O)NCC(=O)[O-]
|
|
386
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
387
|
|
|
388
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
389
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
390
|
CCOC(=O)c1c(n(c2c1-c3c(non3)CC2)OC)C
|
|
391
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
392
|
Cc1ccc(c(c1)c2cc(n[nH]2)C(=O)Nc3nnc(s3)C)O
|
|
393
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
394
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
395
|
COC(=O)c1cc2cc(oc2[nH]1)C#N
|
|
396
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
397
|
C[C@@H]1CCCN(C1)C(=O)c2c(c(ns2)c3ccccn3)N
|
|
398
|
c1cn(cn1)c2cc(=O)[nH]c(n2)N
|
|
399
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
400
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
401
|
Cc1ccc2c(c1)C=Cc3ccccc3O2
|
|
402
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
403
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
404
|
c1cc(ccc1Cn2c(=O)oc(n2)c3ccoc3)C#N
|
|
405
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
406
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
407
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
408
|
CCOC(=O)c1ns/c(=NCCCC#N)/n1C
|
|
409
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
410
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
411
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
412
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
413
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
414
|
Cc1cc(=O)c(c(o1)Nc2ccccc2)C(=O)C
|
|
415
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
416
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
417
|
c1ccc(cc1)[C@@H]2C=C(N3C(=N2)N=NN3)c4ccccc4
|
|
418
|
c1ccc2=NC3=[NH+]CCN3C(=c2c1)[O-]
|
|
419
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
420
|
c1ccc2c(c1)N(CCO2)c3ccc(s3)C(=O)[O-]
|
|
421
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
422
|
c1ccc2c(c1)C[C@@H]3CNCc4c3c(ccc4)S2
|
|
423
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
424
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
425
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
426
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
427
|
Cc1cc(n(n1)C)NS(=O)(=O)c2c(n(cn2)C)Cl
|
|
428
|
c1c2c(n[nH]c1=O)CCCC2
|
|
429
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
430
|
c1ccc(cc1)Oc2nc3ccc(nn3c(=O)n2)Cl
|
|
431
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
432
|
Cn1c2nc(c(n2c(=O)n(c1=O)C)Cc3ccccc3)Cl
|
|
433
|
Cc1c2c(onc2c(=O)[nH]n1)C
|
|
434
|
CCO[S@@](=O)c1c(n2ccccc2n1)S(=O)(=O)[NH-]
|
|
435
|
CCOC(=O)c1c(c(cn1C)NC(=O)OCc2ccccc2)O
|
|
436
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
437
|
c1ccc2c(c1)CCc3c(cc(cc3O2)N)N
|
|
438
|
c1cc(ccc1SCCCn2ccnc2)Cl
|
|
439
|
Cc1nnc(o1)C(=O)c2c(c3ccccc3n(c2=O)C)OC(=O)C
|
|
440
|
c1ccc(cc1)CNc2cnccn2
|
|
441
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
442
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
443
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
444
|
Cc1nc(no1)c2ncon2
|
|
445
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
446
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
447
|
COC(=O)c1cc(=O)n2c(c1C(=O)c3cccs3)SCC2
|
|
448
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
449
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
450
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
451
|
COc1cccc(c1)C2=CCN(C(=O)N2)c3ccccc3O
|
|
452
|
CCC(=O)c1cc(c(c(c1)Sc2cccc3c2nccc3)O)C
|
|
453
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
454
|
c1cc(=O)n(cc1C(F)(F)F)Cc2nnnn2C3CC3
|
|
455
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
456
|
c1ccc(cc1)CC2=C(C=NC(=O)C2)C(=O)N
|
|
457
|
c1ccc2c(c1)Cc3cc(sc3C=C2)Cl
|
|
458
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
459
|
c1ccc(cc1)OC(=O)N2CC=C(C=C2)n3c4ccccc4nn3
|
|
460
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
461
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
462
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
463
|
CCS(=O)(=O)Nc1cnn(c1C)C
|
|
464
|
CC(=O)N1CCC(=CC1)c2c[nH]c3c2cccn3
|
|
465
|
Cc1cc(n(n1)C)C(=O)c2c(nn(c2Cl)C)C
|
|
466
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
467
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
468
|
c1ccc(cc1)n2cc(cn2)CN3CCSc4c3cccc4
|
|
469
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
470
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
471
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
472
|
CCOC(=O)c1cnc(nc1Sc2nnc(s2)C)SC
|
|
473
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
474
|
c1c[nH]nc1C(=O)NC2CC2
|
|
475
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
476
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
477
|
c1c(cc2c3c1occ3CC(=O)O2)O
|
|
478
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
479
|
C1CCC(CC1)[C@@H]2CC(=O)NC3C2C(OC(=O)C3C#N)N
|
|
480
|
C1CCC(CC1)NC2CCC3N(C2=O)CCC3
|
|
481
|
c1ccnc(c1)c2ccc(s2)NC(=O)N3CCOCC3
|
|
482
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
483
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
484
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
485
|
[H]/N=c/n(nc(s1)N2CCOCC2)Cc3ccccc3
|
|
486
|
c1ccc2c(c1)CCC(=C2)c3cccnc3
|
|
487
|
Cn1c2ccccc2n(c(=O)c1=O)Cc3ccon3
|
|
488
|
Cc1ccc(cc1)c2nc(c(nn2)C)Sc3ccc(cc3)F
|
|
489
|
c1ccc2c(c1)CC(=O)c3cccn3C2
|
|
490
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
491
|
c1ccc(cc1)c2nnc(s2)Oc3ccc4ccc(=O)oc4c3
|
|
492
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
493
|
c1cc2c(cc1F)Sc3ccc(cc3CO2)Cl
|
|
494
|
c1cc(oc1)/C=c/2c(=O)[nH]/c(=Cc3ccco3)/c(=O)[nH]2
|
|
495
|
COC(=O)c1c(c2c([nH]1)c3ccccc3n4c2nnn4)N
|
|
496
|
|
|
497
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
498
|
CCOC(=O)c1c(n(c(=O)s1)c2ccccc2)N
|
|
499
|
c1cc(=O)oc2c1cc3c(c2O)OCC3
|
|
500
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
501
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
502
|
Cc1c(c(on1)C)Cc2ccc(s2)C(=O)[O-]
|
|
503
|
CC[C@@]1(CN(CC=C1)C(=O)OC2CCCCC2)CC(=O)N(C)C
|
|
504
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
505
|
CCCCCCNC(=O)n1cc(c(nc1=O)[O-])F
|
|
506
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
507
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
508
|
Cc1ccccc1CN[C@@H]2COC[C@H]2c3ccc(cc3)F
|
|
509
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
510
|
c1cc(=O)c2c(c1=O)sc3c(=O)ccc(=O)c3s2
|
|
511
|
CCc1cc2c(s1)S[C@@H](NC2=O)c3ccccc3
|
|
512
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
513
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
514
|
c1cc(ccc1[C@@]2(CSc3n2c(=O)cc(c3)N)O)Cl
|
|
515
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
516
|
C/C(=C/C1CCCCC1)/CCC2=N[C@@H](CO2)C(=O)OC
|
|
517
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
518
|
COC1CCC2C(C1)O[C@@]3(C4CC5C(CC4O[C@@H]3C2)OCO5)O
|
|
519
|
c1cnc(nc1)N2CCC[C@H]2c3nc(no3)c4cncnc4N
|
|
520
|
C1C2C(NCN1)SC=C(N2)O
|
|
521
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
522
|
|
|
523
|
CC[C@@H]1C2=C(CN(C2=O)CC(=O)[O-])NC(=O)N1
|
|
524
|
CCOC(=O)N1CCN(CC1)C2NNC3NCCN3N2
|
|
525
|
c1ncn(n1)Sn2cncn2
|
|
526
|
Cc1c(c(on1)C)/C=C/c2c(=O)[nH]c3ccccc3n2
|
|
527
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
528
|
CCCn1c(n[nH]c1=O)c2cccs2
|
|
529
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
530
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
531
|
c1ccc(cc1)C(=O)C2=Nc3ccccc3/C(=Cc4ccccn4)/N2
|
|
532
|
|
|
533
|
c1ccn(c1)c2c(c3c(s2)CN(CC3)c4cccc(n4)F)C#N
|
|
534
|
c1c2c(sc1Cn3cc(c(nc3=O)[O-])C#N)CCCC2
|
|
535
|
c1ccc2c(c1)c-3nc4ccc(cc4[nH]n3c2=O)N
|
|
536
|
CC1C(NNN1/C=C/C2CCCCC2)C(=O)[O-]
|
|
537
|
C[C@@H](c1ccncn1)N(C)Cc2ccc(o2)Sc3ncccn3
|
|
538
|
C[C@@]12CCC3=C([C@@H]1CCCC2=O)CSc4c3ccc(c4)OC
|
|
539
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
540
|
CS(=O)(=O)n1cnc2c1cccc2
|
|
541
|
CCOC(=O)N1CN(Cc2c1oc3ccccc3c2=O)CCO
|
|
542
|
|
|
543
|
c1ccc(cc1)[C@@H]2C3=C(c4ccccc4CC3)NC(=O)N2
|
|
544
|
Cc1cccc2c1[nH]c3c2OC(CC3=O)(C)C
|
|
545
|
CN(C)C(=O)n1c(nnn1)Cc2ccc(cc2)c3ccccc3
|
|
546
|
c1ccc(cc1)S(=O)(=O)C[C@@H]2CSc3n2ncn3
|
|
547
|
c1ccc2c(c1)[C@@H]3N(C2=O)c4ccccc4S3
|
|
548
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
549
|
Cc1nnn(n1)Cc2nnnn2C
|
|
550
|
C[C@@]12CCC(=O)N1C3CNCNC3N2
|
|
551
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
552
|
c1cc(ccc1c2c3ccoc3ccn2)C(=O)N
|
|
553
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
554
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
555
|
Cn1cc(cn1)S(=O)(=O)N2CCCn3c2ccn3
|
|
556
|
CCOC(=O)c1c-2c(c(=O)oc1N)C(=O)c3c2cccc3
|
|
557
|
C[C@@H](Cc1ccccc1)N(CC#C)C(=O)OC2=CCN(CC2)C
|
|
558
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
559
|
C[C@@H]1NC(=C2C(=N1)NC[NH]2)C(=O)N
|
|
560
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
561
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
562
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
563
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
564
|
CCn1c2ccccc2nc1c3cnn(n3)c4ccccc4
|
|
565
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
566
|
c1ccc2c(c1)c(=O)c3=c(c2=O)sc(c(s3)C#N)C#N
|
|
567
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
568
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
569
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
570
|
CCOC(=O)CNC1=c2ccccc2=[S@@](=O)(N=N1)O
|
|
571
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
572
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
573
|
Cc1cc(no1)c2nnc(o2)N
|
|
574
|
|
|
575
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
576
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
577
|
c1ccc2cc(ccc2c1)Nc3ccc(cc3)O
|
|
578
|
Cc1c(n2ccccc2n1)Sc3ccccc3
|
|
579
|
CCNc1nc(nc(n1)Sc2ccc(cc2)C(=O)OC)N
|
|
580
|
CC1CCC(CC1)S(=O)(=O)NC2CC(C3C(C2C)CCN=C3)C
|
|
581
|
C=C1/C(=C/C2CCCS2)/C(=O)N([NH]1)C3CCCCC3
|
|
582
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
583
|
c1ccc(cc1)N(CCC#N)c2c(c3ccccc3s2)Cl
|
|
584
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
585
|
Cc1nc(c(o1)C(F)(F)F)c2nc(on2)c3ccccc3
|
|
586
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
587
|
|
|
588
|
CCOC(=O)c1cnc2c3c1onc3CCC2
|
|
589
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
590
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
591
|
C1CCC2CC3C(CC2C1)[C@@]4(C5CCCCC5C(=O)[C@@]4(O3)O)O
|
|
592
|
CC(C)N1C(NNN1)SC2CNN(C(=O)C2CL)C
|
|
593
|
Cc1c(sc2c1/c(=[NH+]/Cc3cn4ccccc4n3)/nc[nH]2)C
|
|
594
|
Cc1ccc(cc1)S(=O)(=O)n2ccc3c2C(=O)[C@@H](C3)C
|
|
595
|
c1cc(oc1)CN2Cc3cc(=O)n4c(=N[C@@H]5[C@@H]4C=CC=C5)c3=C2N
|
|
596
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
597
|
Cc1c(c2c(c(c1O)C)C[C@@H](O2)CCn3ccc(=O)c(c3C)O)C
|
|
598
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
599
|
CCCn1c2=N[C@@H](C(=c2c(=O)[nH]c1=O)[O-])C
|
|
600
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
601
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
602
|
Cc1cc(=O)n(c(c1C#N)[O-])Nc2ccccc2
|
|
603
|
C1CCC2C(C1)CCC3C(C4CCCCC4[NH]3)C2
|
|
604
|
Cc1ccc2nc(cn2c1)Cn3nc(nn3)c4ccccc4
|
|
605
|
c1cc(ccc1C(=O)[O-])Oc2c(nccn2)N3CCCC3
|
|
606
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
607
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
608
|
C1CC2C3C(CO2)CCCC3C1O
|
|
609
|
CCOC(=O)N1CCC2C([NH]OC2=O)CC1
|
|
610
|
Cc1c(nn(n1)c2ccccc2)C(=O)n3cccc3
|
|
611
|
c1cc(ccc1[C@@H](c2ccns2)O)F
|
|
612
|
c1ccc(c(c1)C(=O)C2=C[C@H](C(=O)N=C2)C#N)O
|
|
613
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
614
|
c1ccc2c(c1)nc(c(=O)o2)N
|
|
615
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
616
|
c1ccc2c(c1)ncc3n2ncc3
|
|
617
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
618
|
CCc1nnc(o1)Cn2cnc3ccccc3c2=O
|
|
619
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
620
|
c1ccc2c(c1)nn(n2)Cc3nc4ccccc4s3
|
|
621
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
622
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
623
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
624
|
Cc1cn2c3c1CCCCn3c(n2)CN4CCCc5c4cccc5
|
|
625
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
626
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
627
|
c1ccc2c(c1)nnn2[C@H]3CCC[C@@H]4N3CCn5c4ccc5
|
|
628
|
CCOC(=O)c1c(=O)c2c(n3c1[NH2+]CC3)CCC2
|
|
629
|
c1ccc(c(c1)c2nc([nH]n2)CC(=O)[O-])O
|
|
630
|
c1ccc2c(c1)CC=N[C@@H]2Cn3c4ccccc4nn3
|
|
631
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
632
|
c1ccc(cc1)n2c(cnn2)Cn3cnc4ccccc4c3=O
|
|
633
|
Cn1c2c(cn1)CN(CC2)S(=O)(=O)c3ccc(cc3)Cl
|
|
634
|
C1CC(C(=O)N(C1)CC2NNC(O2)C3CC3)C(F)(F)F
|
|
635
|
CCn1c2ccccc2n(c1=O)Cc3nnc(s3)SC
|
|
636
|
CC1=C(Sc2nc3ccccc3c(=O)n2N1)C(=O)[O-]
|
|
637
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
638
|
CN1C(=O)C(=C(C12CCC2)N)S(=O)(=O)c3ccc(cc3)Cl
|
|
639
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
640
|
c1ccc(cc1)/C/2=N/CCOC(=O)c3c2cccc3
|
|
641
|
CCn1cc(cn1)c2cncn2CCCC(C)(C)CO
|
|
642
|
Cc1cc(c(c(c1)C)Oc2c(c(cc(n2)C)O[C@@H]3CCOC3)C)C
|
|
643
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
644
|
|
|
645
|
CN1c2ccccc2S[C@@H]1c3ccco3
|
|
646
|
|
|
647
|
c1csc(c1Cl)c2c[nH]c(c2C#N)N
|
|
648
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
649
|
Cc1c(non1)NCn2cnc3c2c(=O)n(c(=O)n3C)C
|
|
650
|
c1cc(cnc1)c2cccs2
|
|
651
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
652
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
653
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
654
|
c1ccc-2c(c1)CCc3c2n[nH]c3
|
|
655
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3cnc4ccccc4c3=O
|
|
656
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
657
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
658
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
659
|
Cc1c2c([nH]c(=O)n(c2=O)Nc3ccc(cc3)O)sn1
|
|
660
|
|
|
661
|
C1CCC2C(C1)CCN3[C@@H]2CCC4=C3CNC4=O
|
|
662
|
COC(=O)c1c2cccc3c2c(o1)-c4ccccc4C3=O
|
|
663
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
664
|
C1NC2C(C(N1)N)NCNC2N
|
|
665
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
666
|
C/C(=C/C(=NC(=NC1=O)O)O)/Nc2cccc(c2)C(F)(F)F
|
|
667
|
C[C@@H]1CCCC[C@@H]1NC(=O)COc2cnc(nc2)c3ccccc3
|
|
668
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
669
|
c1cc(c2c(c1)[C@@H](c3cc(cnc3C=C2)N4CCCC4)O)C#N
|
|
670
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
671
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
672
|
CNC(=O)Oc1ccccc1
|
|
673
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
674
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
675
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
676
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
677
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
678
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
679
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
680
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
681
|
COC(=O)/C=C/C(=O)N2c3ccccc3[N-]C2=N1
|
|
682
|
Cc1ccc2c(c1)-c3cc(nn3[C@H](N2)c4ccccc4)C
|
|
683
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
684
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
685
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
686
|
CCCCCCC1CN[NH]N1
|
|
687
|
c1ccc(cc1)c2cnc3n2nccc3
|
|
688
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
689
|
c1c2c(n[nH]c1=O)CCOC2
|
|
690
|
|
|
691
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
692
|
COc1c2c(ncn1)CCNC2
|
|
693
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
694
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
695
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
696
|
c1ccc2c(c1)Cc3ccccc3N=C2C#N
|
|
697
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
698
|
Cc1cc(n(n1)CCc2nnc(n2C)SC)C
|
|
699
|
c1ccc(cc1)c2nccnn2
|
|
700
|
COc1ccccc1C/C=C/c2cccs2
|
|
701
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
702
|
C1CC(OC1)N2C(=O)C(C[NH]C2=O)F
|
|
703
|
c1cc(cnc1)C(=O)c2ccco2
|
|
704
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
705
|
C1CCc2c(c3n(n2)CCNC3=O)C1
|
|
706
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
707
|
CC1=Nc2c(ncn2N=C(C1)C)C#N
|
|
708
|
C[C@@H]1Cc2ccccc2N1c3c(c(=O)c3=O)c4ccccc4
|
|
709
|
Cn1c(=O)c(c(cn1)[C@@H](C#N)c2[nH]c3ccccc3n2)Cl
|
|
710
|
c1ccc(cc1)c2c3ccccc3[nH]c(=O)c2n4cnc(n4)C#N
|
|
711
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
712
|
CC1NC2C(C(CS2)OC(=O)C)C3N1C4CCCCC4N3
|
|
713
|
CC(=O)O[C@@H]1C=Cc2ccc3c4c2c1ccc4CC=C3OC(=O)C
|
|
714
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
715
|
|
|
716
|
C1CC2N(C1)CC3CC4C(CC3N=C2)OCO4
|
|
717
|
C1CCC2C(C1)C=CC3CCCCC3S2
|
|
718
|
CC1C2C(NCN1)S[C@@H](CC2)O
|
|
719
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
720
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
721
|
CSc1nnc(s1)CN2CCSc3c2cccc3
|
|
722
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
723
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
724
|
CCCCc1ccc(cc1)On2ccc(=O)cc2
|
|
725
|
CCOC(=O)c1ccc(=O)c2cccc3c2c1C=C3
|
|
726
|
CC(=O)c1ccc2c(c1)SCc3ccccc3O2
|
|
727
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
728
|
C[C@@H](Cc1ccco1)NC(=O)C
|
|
729
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
730
|
CCS(=O)(=O)N1CCC[C@@H](C1)C(=O)Oc2cccnc2
|
|
731
|
Cc1cc([nH]n1)OCCC#N
|
|
732
|
c1ccc(cc1)c2nnn(n2)CCS(=O)(=O)N3CCOCC3
|
|
733
|
CCOC(=O)C=NN=C/C1=N/NSC2CCC(CC2)C
|
|
734
|
C1CCC2C(C1)CC[C@@H]2CC3CCCCN3
|
|
735
|
c1ccc2c(c1)CCC3=C(C=C2)C(=O)OC3
|
|
736
|
Cc1c2ccccc2nc(c1C(=O)[O-])Cn3cccn3
|
|
737
|
CC1=C[C@@H](c2c1nc3ccccc3n2)c4cnc5ccccc5n4
|
|
738
|
c1cc(=O)oc2c1cc3c(c2O)OC=CC3
|
|
739
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
740
|
c1nnc(s1)NC(=O)[C@H]2C(=C3CCCCC3=NC2=O)[O-]
|
|
741
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
742
|
CCCC(=O)/[NH+]=c/cc(c-2c(oc3ccccc3c2n1)O)C
|
|
743
|
c1ccc2c(c1)N(CCO2)C(=O)n3ccnc3
|
|
744
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
745
|
CN1CC(=C(C1=O)O)c2ccc(cn2)Cc3ccc(cc3)F
|
|
746
|
c1ccc2c(c1)CC3=C2NC(=O)N[C@@H]3c4ccccn4
|
|
747
|
Cc1cc(nc(n1)C2=[NH+]c3ncnn3[C@@H](N2)c4ccccc4)C
|
|
748
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
749
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
750
|
c1ccnc(c1)[S@@](=O)c2cncs2
|
|
751
|
c1ccc(cc1)CCN2CC3=C(CCCC3=O)NC2
|
|
752
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
753
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
754
|
CCOc1c(o/c(=NC(=O)c2ccccc2)/s1)C(=O)OCC
|
|
755
|
C1Cc2c(n[nH]c2C(=O)[O-])C1
|
|
756
|
CC(C)(C)OC(=O)Nc1c[nH]nc1
|
|
757
|
CN(Cc1nnc(s1)SC)c2ccccc2F
|
|
758
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
759
|
c1ccc(cc1)c2c3ccccc3nnn2
|
|
760
|
|
|
761
|
Cc1ccc(cc1)S(=O)(=O)Nn2c(c(nn2)c3ccccc3)C
|
|
762
|
c1ccc2c(c1)N=C(CN2C(=O)NCC(=O)[O-])O
|
|
763
|
Cc1c(nnn1c2ccccc2)S(=O)(=O)c3ccccc3
|
|
764
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
765
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
766
|
CC1(C=CN(C=C1)C(=O)C2=NC=CC2)C
|
|
767
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
768
|
CCOC(=O)/C=C/CCCc2c1cco2
|
|
769
|
|
|
770
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
771
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
772
|
CN1C=NC2C(NCN2[C@@H]3CC[C@@H](O3)CO)[C@@H]1O
|
|
773
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
774
|
c1ccc2c(c1)ccc3c2[C@@H]4CC[C@H](O3)O4
|
|
775
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
776
|
C1CCC(CC1)CNC(=O)/N=C/2N-3C(NS2)CC4C3CCCC4
|
|
777
|
c1ccc2c(c1)C3c4ccccc4C2O3
|
|
778
|
COC(=O)c1cc2c(s1)CN(C2)c3ccccc3Cl
|
|
779
|
C1CCC(CC1)S(=O)(=O)OC2CCC(NN2)[O-]
|
|
780
|
Cc1cn(c(n1)c2cccnc2)c3ccc(cc3)S(=O)(=O)C
|
|
781
|
CC(=O)n1c2ccccc2c3c1sc(c3C#N)N4CCCCC4
|
|
782
|
C1CC(CCC1CC2CC(=O)C3C(S2)CCS3)F
|
|
783
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
784
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
785
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
786
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
787
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
788
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
789
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
790
|
Cc1c(c(sn1)NC)C(=O)/N=c/2
(ccs2)C
|
|
791
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
792
|
CCOC(=O)c1[nH]nc(n1)N
|
|
793
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
794
|
Cc1ncc(n1c2nc(cs2)c3ccccc3)NC(=O)C
|
|
795
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
796
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
797
|
CC1=CC(=C(O[C@@H]1c2cccnc2)C)C(=O)OC
|
|
798
|
Cc1c2c(ncnc2on1)N
|
|
799
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
800
|
COC1=C(C(=O)O[C@@H]2[C@@H]1C=CC=C2)Cc3ccccc3
|
|
801
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
802
|
c1ccc2c(c1)[C@@H]3c4cccn4CCN3C2=O
|
|
803
|
C1CCC2C(C1)CCC3C2CN=C4N3C(=O)CC4
|
|
804
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
805
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
806
|
c1ccc2c(c1)[C@@H]3C[C@H]2C(=O)c4c3cccc4
|
|
807
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
808
|
CCN1CC(=O)N=C1NCCc2cccc(c2)Cl
|
|
809
|
COC(=O)CCCC1CCC(=O)N2C1NCCC2
|
|
810
|
CCOC(=O)c1ccc2c(c1)[nH]c(c2O)c3ccccc3
|
|
811
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
812
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
813
|
COc1c2c(ncn1)SCC(=O)N2
|
|
814
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
815
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
816
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
817
|
c1ccn(c1)Nc2ccncc2
|
|
818
|
Cc1nc(on1)CN2CCSc3c2cccc3
|
|
819
|
c1ccc2c(c1)-c3ccccc3N=CN2
|
|
820
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
821
|
C/C=C/N1[C@H]2C=C[C@@H](C1=O)C(=C2C(=O)OC)C(=O)OC
|
|
822
|
Cc1c(sc(=O)n1NC(=O)Cc2ccccc2)c3ccccc3
|
|
823
|
Cc1nc(c(o1)NCCc2nc(no2)c3ccccc3)C#N
|
|
824
|
Cc1ccc(n1c2[n-]c(nn2)SCCCC(=O)[O-])C
|
|
825
|
COCCn1c(=O)c2c(nn1)scn2
|
|
826
|
CC1(Cc2c(cc3c(n2)Nc4ccccc4N=C3O)CO1)C
|
|
827
|
CCOC(=O)c1c(c2c(cccc2s1)F)Cn3cnc(n3)C#N
|
|
828
|
c1ccc(cc1)n2cc(cn2)CSc3nncs3
|
|
829
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
830
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
831
|
c1nc(c2c(ncn2n1)C#N)[O-]
|
|
832
|
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
|
|
833
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
834
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
835
|
Cc1c2cc(ccc2[nH]n1)F
|
|
836
|
CN(C)C1NC(SN1)C(=O)C2C[NH]C3C2CCCC3
|
|
837
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
838
|
CCn1cc(cn1)Nc2nccc(n2)OC
|
|
839
|
c1ccc2c(c1)CCc3ccccc3C2
|
|
840
|
CC1=C(Oc2ccccc2N1)C(=O)Nc3ccccc3
|
|
841
|
Cc1cccc2c1nc3c(c2)C=Nc4ccccc4S3
|
|
842
|
c1ccc2c(c1)-c3c(c(c(c(=O)[nH]3)C#N)c4cccnc4)CS2
|
|
843
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
844
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
845
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
846
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
847
|
Cn1c(cc(=O)n(c1=O)C)Cn2ccccc2=O
|
|
848
|
COc1c(c(=O)c2c(s1)CCCC2)N
|
|
849
|
Cc1nc2c(ncnc2o1)N
|
|
850
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
851
|
Cc1c(nccn1)c2ccnn2S(=O)(=O)c3ccccc3
|
|
852
|
CCOC(=O)C1=C(CN(C1)C(=O)OCC)OC
|
|
853
|
c1ccc(cc1)NC(=O)Nc2csc(n2)c3ccncc3
|
|
854
|
c1ccc(cc1)C(=O)NCn2cccnc2=O
|
|
855
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
856
|
Cc1nc(on1)[C@@H](C)Nc2nccc(n2)OC
|
|
857
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
858
|
CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc2c(nccn2)N
|
|
859
|
CCOC(=O)/C=C/1C2NNNN2-C3CCCCC3N1
|
|
860
|
COC(=O)C[C@@H]1Cn2c(ncn2)N=C1O
|
|
861
|
c1ccc2c(c1)C(=O)Nc3ccccc3S2
|
|
862
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
863
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
864
|
c1cc(sc1)c2cncnc2
|
|
865
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
866
|
COc1ccc(cc1)S(=O)(=O)N2C[C@@H](C(=NC2=O)[O-])F
|
|
867
|
CCN(c1ccccc1)C2=CC(=O)N[C@@H]3N2CCCC3
|
|
868
|
c1cc2c(nc1)Sc3cccnc3S2
|
|
869
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
870
|
Cc1nc(cs1)[C@@H]2COc3ccccc3O2
|
|
871
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
872
|
[H]/N=c/nc(ss1)SCc2ccc(cc2)C(=O)OC
|
|
873
|
CCn1c2ccccc2c3c(c1=O)C(=Nc4ccccc4O3)C
|
|
874
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
875
|
c1ccc2c(c1)nnn2CCS(=O)(=O)N3CCCC3
|
|
876
|
c1cc(ccc1SCc2ccsc2c3ncns3)Cl
|
|
877
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
878
|
c1cc(oc1)c2c3c(c4c(n2)C=C[C@@H]5[C@@H]4C=CC=C5)CCC3
|
|
879
|
Cc1cc(=O)oc2c1c(n[nH]2)C
|
|
880
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
881
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
882
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
883
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(c(nc3=O)[O-])C#N
|
|
884
|
c1ccc(c(c1)C2=N/C(=C/c3ccco3)/C(=O)N2)Cl
|
|
885
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
886
|
c1ccc2c(c1)CCc3ccccc3S2
|
|
887
|
Cn1c2c(cn1)c(ncn2)n3cnc4c3cccc4
|
|
888
|
c1cc2c-3c(c1)CCc4n3c(cc4)CC2
|
|
889
|
CS(=O)(=O)c1ccc2c(c1CCC(=O)[O-])O2
|
|
890
|
CC(=O)N1CCC(CC1)c2nnc(s2)c3ccco3
|
|
891
|
CCn1c2ccccc2n3c1nnc3c4cc(nn4C)C
|
|
892
|
c1ccc2c(c1)C(=NS2(=O)=O)Sc3nc4ccccc4o3
|
|
893
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
894
|
c1cn2c(cc1=O)C(=O)NCC2
|
|
895
|
CCOC(=O)C1=C(Sc2ccccc2C1)NC(=O)C
|
|
896
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
897
|
CCNc2ccccc2S/C1=Cc3nc4ccccc4s3
|
|
898
|
c1ccc(cc1)C2=CCNn3cnnc3S2
|
|
899
|
c1ccc(cc1)C2=C/C(=C/c4ccccc4NC3=O)/C(=O)O2
|
|
900
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
901
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
902
|
c1ccc(cc1)c2c([n+]3c4ccccc4sc3s2)O
|
|
903
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
904
|
CCOC(=O)/C=C/1CC(=O)Nc2c(non2)N1
|
|
905
|
Cc1ccc2c(c1)[C@@]3(C(=O)c4ccccc4[C@@]3(O2)O)O
|
|
906
|
c1ccc(cc1)Nn2c3ccccc3nn2
|
|
907
|
C=CCN1C2CCCCC2C(C1O)C3=C4CCCCC4=NC3=O
|
|
908
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
909
|
CC1=CC(=O)Nc2cccc3c2n1nc3
|
|
910
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
911
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
912
|
|
|
913
|
Cc1ccc2c(c1)nnc(n2)N
|
|
914
|
c1ccc2c(c1)nnn2n3c4ccccc4nn3
|
|
915
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
916
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
917
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
918
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
919
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
920
|
Cc1cnc(o1)CN2CCOCC2
|
|
921
|
Cn1c(nnc1SC)Cn2c3ccccc3sc2=O
|
|
922
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
923
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
924
|
CCOC1NNC(S1)CSC2CCCCN2
|
|
925
|
CCOC1=C[C@@H](Oc2c1cccc2)c3ccc(cc3)F
|
|
926
|
Cc1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C=C2
|
|
927
|
COc1c2c(ncn1)SCC(=N2)N
|
|
928
|
c1ccc(cc1)c2cnccn2
|
|
929
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
930
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
931
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
932
|
Cc1nccc(n1)Sc2ccccc2
|
|
933
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
934
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
935
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
936
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
937
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
938
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
939
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
940
|
Cn1c(cnc1Cn2c3ccccc3ncc2=O)Cl
|
|
941
|
COc1ccc2c(c1O)[C@@H]3CCC=CC3=C2
|
|
942
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
943
|
|
|
944
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
945
|
c1ccc(cc1)S[C@@H]2c3ccccc3C(=O)O2
|
|
946
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
947
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
948
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
949
|
CCOC(=O)c1nn(c2n1c(=O)cc(n2)N)c3ccccc3
|
|
950
|
Cc1cnc(s1)Nc2cnc(nc2)SC
|
|
951
|
C[C@@H]1[C@@H](NC2C(CNCN2)N1)C
|
|
952
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
953
|
c1cc(oc1)c2cc3nc4c(c(n3n2)[O-])SCC4
|
|
954
|
CCc1nnc(s1)/N=C(/[C@@H](C2CCCC2)NC(=O)C)[O-]
|
|
955
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
956
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
957
|
C1CCC(CC1)S(=O)(=O)NCCN2CCNC2
|
|
958
|
c1ccc(cc1)COc2cnc(nc2)C#N
|
|
959
|
Cn1c(=O)c(cn(c1=O)Nc2ccccc2)C#N
|
|
960
|
COC(=O)c1c2n(cn1)C[C@@H](OC2=O)COc3ccccc3
|
|
961
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
962
|
c1ccc2c(c1)C(=O)O[C@@]23Oc4cccnc4S3
|
|
963
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
964
|
Cc1ccc(cc1)[S@@](=NC(=O)C)(=O)Oc2ccccc2
|
|
965
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
966
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
967
|
CC1=C(c2ccccc2C1)Sc3ccccc3
|
|
968
|
C1CCC(CC1)[C@@H]2CC/C(=C/3C=CC(=N3)C4CCCCC4)/[NH2+]2
|
|
969
|
c1ccc2c(c1)ncc3n2c(=O)on3
|
|
970
|
CN(C)C(=O)Sc1cccnc1
|
|
971
|
c1ccc(cc1)S(=O)(=O)n2cc(c(nc2=O)[O-])F
|
|
972
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
973
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
974
|
CSC1C2C(CCN1)N[NH]N2
|
|
975
|
C1CCC(CC1)C2=N[C@@H]3C4CCCCC4[C@H]2O3
|
|
976
|
c1cc(ccc1C2=NC(=CC2)c3ccncc3)Cl
|
|
977
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
978
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
979
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
980
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
981
|
c1ccc(cc1)[C@@H]2Nc3c(cnn3c4ccccc4)C(=O)N2
|
|
982
|
Cc1ccc(n1c2cnccn2)C
|
|
983
|
CC(C)CN1N(O1)CCOC(=O)NC2CCCCC2
|
|
984
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
985
|
|
|
986
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
987
|
CN(c1ccc(cc1)OC)c2c3c(ccn2)ccs3
|
|
988
|
C[C@@]1(C[C@@H](NC2N1NCN2)C3CCCCC3O)O
|
|
989
|
CCOC(=O)C1=CNc2ccccc2N=C1N
|
|
990
|
Cc1ncc(s1)CN(C)[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
991
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
992
|
c1cc2c3c(c1)NC(=O)C4=C(N3CCC2)CCC4
|
|
993
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
994
|
c1ccc2c(c1)n3cccc3c(=O)s2
|
|
995
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
996
|
Cc1nc(n(n1)CCNC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
997
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
998
|
CC1(C=Nc2c(cc(=O)c-3c(c4ccccc4n(c23)C)O)O1)C
|
|
999
|
C[C@@H](c1ccccc1)Nc2cc3c(cn2)onc3c4ccccc4
|
|
1000
|
CC(=O)NC1=N[C@@H](CC(=O)N1)c2ccc(cc2)OC
|
Mouse click action: | Basic controls: | |||||||
---|---|---|---|---|---|---|---|---|
Left-Click to rotate Shift-Left-Click up & down to zoom Right-Click for Jmol's context menu | ||||||||
Jmol: an open-source Java viewer for chemical structures in 3D.http://www.jmol.org/ | ||||||||