(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
2
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
3
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
4
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
5
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
6
|
c1ccc(c(c1)/C=c/c(n/c(=C/C(=O)N3CCCC3)/s2)[O-])O
|
|
7
|
|
|
8
|
c1ccc(cc1)C2=N/C(=Cc3ccc4c(c3)OCO4)/C(=N2)O
|
|
9
|
|
|
10
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
11
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
12
|
Cc1c(cnn1c2ccccc2)c3nnc(o3)[O-]
|
|
13
|
|
|
14
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
15
|
CCOCc1cn(c(nc1=[NH2+])C)CC(=O)c2ccccc2
|
|
16
|
C[S@@](=NCn1c2ccccc2nn1)(=O)c3ccccc3
|
|
17
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
18
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
19
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
20
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
21
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
22
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
23
|
c1cc(oc1)C2=CC(=O)Nc3c(non3)N2
|
|
24
|
CCOC(=O)Cn1nc(nn1)CSc2ccc(cc2)Cl
|
|
25
|
CC(=O)Nc1nccc(n1)c2cc(no2)c3ccccc3
|
|
26
|
|
|
27
|
CCc1ccc(cc1)[N-]S(=O)(=O)c2cc([nH]n2)C(=O)OCC
|
|
28
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
29
|
Cc1c(c2nnc3c(=O)[nH]oc3n2n1)c4ccccc4
|
|
30
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
31
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
32
|
c1ccc(cc1)C2=CSc3nc(nc(=[NH2+])n3N2)N
|
|
33
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
34
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=O)NC(=[NH+]2)N3CCCCC3
|
|
35
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
36
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
37
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
38
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
39
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
40
|
C1CCC(CC1)[C@@H]2CC/C(=C/3C=CC(=N3)C4CCCCC4)/[NH2+]2
|
|
41
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
42
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
43
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
44
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
45
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
46
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
47
|
c1cc(cnc1)C#CCCN2CCC(=CC2)c3cccs3
|
|
48
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
49
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
50
|
Cn1c2ccccc2nc1Cn3nc(nn3)c4ccccc4
|
|
51
|
c1ccc2c(c1)c(=O)n(nn2)Cn3c(=O)oc(n3)c4cccs4
|
|
52
|
|
|
53
|
CCOC(=O)c1c2nc([nH]n2cn1)C(=O)C
|
|
54
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
55
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
56
|
CCCCCCNC(=O)n1cc(c(nc1=O)[O-])F
|
|
57
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
58
|
c1ccc(cc1)C2=Nc3c(non3)NC=C2
|
|
59
|
|
|
60
|
c1ccc(cc1)n2cnc3c2cncn3
|
|
61
|
CCOc1nnc(s1)Cn2nc(nn2)c3ccccc3
|
|
62
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
63
|
c1ccc(cc1)CNc2c(non2)O
|
|
64
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
65
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
66
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
67
|
c1cc(sc1)c2cc(c(nn2)O)NC(=O)C3CCC3
|
|
68
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
69
|
Cc1cc(no1)/N=C(C)/Cc2nc(sn2)NC[C@H]3CCCO3
|
|
70
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
71
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
72
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
73
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
74
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
75
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
76
|
c1ccc2c(c1)ccn2Cc3nnc(s3)Cc4cccs4
|
|
77
|
c1ccc(cc1)c2nnc(o2)Sc3nc4ccccc4s3
|
|
78
|
c1ccc(cc1)c2nc(cs2)Cn3c4ccccc4nn3
|
|
79
|
CN(C)c1ccc(cc1)[C@@H]2NC[C@@H](O2)CSc3ccccn3
|
|
80
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
81
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
82
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
83
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
84
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
85
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
86
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
87
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
88
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
89
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
90
|
Cn1c2c(cn1)c(ncn2)Sc3nnc(o3)c4cccnc4
|
|
91
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
92
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
93
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
94
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
95
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
96
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
97
|
COC(=O)c1cc2c(o1)Sc3ccccc3NC2=O
|
|
98
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
99
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
100
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
101
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
102
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
103
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
104
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
105
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
106
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
107
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
108
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
109
|
C[C@@]1(C[C@@H](NC2N1NCN2)C3CCCCC3O)O
|
|
110
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
111
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
112
|
|
|
113
|
c1cc(ccc1Cn2c(=O)oc(n2)c3ccoc3)C#N
|
|
114
|
CCO[C@@H]1C=C/C(=C/C#Cc2ccccc2)/O1
|
|
115
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
116
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
117
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
118
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
119
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
120
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
121
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
122
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
123
|
c1ccc(cc1)C#CNCCOc2ccccn2
|
|
124
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
125
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
126
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
127
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
128
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
129
|
Cc1ccc(cc1)OCn2cc(cn2)N
|
|
130
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
131
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
132
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
133
|
CCCNC(=O)Cc1nc[nH]n1
|
|
134
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
135
|
CN(CC#CCN(C)C1=NC(=O)CC1)C2=NC(=O)CC2
|
|
136
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
137
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
138
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
139
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
140
|
Cc1nn(c(=O)n1N)Cc2nnc(s2)Nc3ccccc3
|
|
141
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
142
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
143
|
c1cc(oc1)c2ccnc(n2)N
|
|
144
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
145
|
|
|
146
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
147
|
CCOC1NC(=O)N(S1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
148
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
149
|
c1ccc(cc1)c2cc(nc(n2)C(=O)Nc3[n-]nnn3)O
|
|
150
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
151
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
152
|
c1ccc(cc1)Nc2nc(ns2)N
|
|
153
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
154
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
155
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
156
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
157
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2cccs2
|
|
158
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
159
|
c1ccc(cc1)Nc2nccs2
|
|
160
|
|
|
161
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
162
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
163
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
164
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
165
|
Cc1nc(on1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
166
|
CCO[C@@H]1C[C@@H](C=CO1)c2ccccc2
|
|
167
|
CC1NC(CN1C)S(=O)(=O)[N-]C2CNN(C2)CC(=O)OC
|
|
168
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
169
|
Cc1ccnc(c1)Nc2ccc(nn2)NCCNC(=O)C
|
|
170
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
171
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
172
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
173
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
174
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
175
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
176
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
177
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
178
|
Cc1ccc(cc1)S(=O)(=O)Nn2nc(nn2)c3ccccc3
|
|
179
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
180
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
181
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
182
|
Cc1n[nH]/c(=NC(=O)CCC(=O)NC2CCCCC2)/s1
|
|
183
|
CCC/N=c/c(=N/c2cccnc2)/c(c1O)O
|
|
184
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
185
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
186
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
187
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
188
|
|
|
189
|
|
|
190
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
191
|
|
|
192
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
193
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
194
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
195
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
196
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
197
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
198
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
199
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
200
|
c1ccc(cc1)S(=O)(=O)Nc2cc3cnnn3c(n2)N
|
|
201
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
202
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
203
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
204
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
205
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
206
|
Cc1nc(c(o1)NCCc2nc(no2)c3ccccc3)C#N
|
|
207
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
208
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
209
|
CCNc1nc(nc(n1)Sc2ccc(cc2)C(=O)OC)N
|
|
210
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
211
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
212
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
213
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
214
|
c1ccc(cc1)S(=O)(=O)[N-]c2ncccn2
|
|
215
|
c1ccc(cc1)C(=O)NCn2cccnc2=O
|
|
216
|
Cc1cn2c(nc(nc2n1)c3ccccc3)N
|
|
217
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc2cc(no2)C)[O-]
|
|
218
|
CCCCc1cn(nn1)CC2CCN(CC2)C(=O)C
|
|
219
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
220
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
221
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
222
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
223
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
224
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
225
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
226
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
227
|
c1cc(cc(c1)C(F)(F)F)c2ccc(o2)c3csnn3
|
|
228
|
c1ccc(cc1)C#CC(=O)c2cccs2
|
|
229
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
230
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
231
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
232
|
|
|
233
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
234
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
235
|
c1c[nH]nc1C(=O)NC2CC2
|
|
236
|
CS(=O)(=O)NC1=NCN(CN1)C2CC2
|
|
237
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
238
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
239
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
240
|
|
|
241
|
c1ccc(cc1)c2nc(on2)SCC(=O)[O-]
|
|
242
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
243
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
244
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
245
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
246
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
247
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
248
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
249
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
250
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
251
|
c1ccc(cc1)NC(=O)/C=c/c(nc3n2ncn3)O
|
|
252
|
CCOC(=O)N=c1oc2ccccc2o1
|
|
253
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
254
|
CCOC(=O)C1=C(Oc2ccccc2NC1=O)N
|
|
255
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
256
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
257
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
258
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
259
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
260
|
c1ccc(cc1)NC2=NCCCO2
|
|
261
|
c1ccc2c(c1)nn(n2)Cc3nc4ccccc4s3
|
|
262
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
263
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
264
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
265
|
|
|
266
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
267
|
Cc1ccccc1OCC(=O)Nn2c(nnn2)Nc3ccccc3
|
|
268
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
269
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
270
|
|
|
271
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
272
|
c1cnn(c1)Cc2nnc3n2CCC3
|
|
273
|
CS(=O)(=O)NC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
274
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
275
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
276
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
277
|
|
|
278
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
279
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
280
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
281
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
282
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
283
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
284
|
Cc1c(sc(=O)n1NC(=O)Cc2ccccc2)c3ccccc3
|
|
285
|
CCOC1CNNN1C2CCN(CC2)C(=O)OCC
|
|
286
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
287
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
288
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
289
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
290
|
c1ccc(cc1)c2cn(nn2)CC(=O)[O-]
|
|
291
|
C1CCC(CC1)C(=O)C#CC2C[NH]C(=O)[NH]C2=O
|
|
292
|
CCCCCCC1CN[NH]N1
|
|
293
|
CCNC(=O)Nc1nc2cc(ccn2n1)c3cccnc3
|
|
294
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
295
|
Cc1cc(nc(n1)N)Nn2cnnc2
|
|
296
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
297
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
298
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
299
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
300
|
Cc1ccn(n1)CC/N=C/[C@@H](C(=O)C2=O)NCCCOC
|
|
301
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
302
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
303
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
304
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
305
|
c1cc(oc1)c2nc([nH]n2)N
|
|
306
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
307
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
308
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
309
|
COc1ccc(cc1)/C=C/C(=O)N=C(S2)CC(=O)C3CC3
|
|
310
|
Cn1c(=O)c2c(c(n[nH]2)c3ccccc3)[nH]c1=O
|
|
311
|
CCc1nnc(o1)Cn2c(noc2=O)c3ccccc3
|
|
312
|
CCOc1c(c(=O)c1=O)Nc2ccccc2
|
|
313
|
c1ccc(cc1)/C=C/Cn2c(=O)c3c(cccn3)oc2=O
|
|
314
|
Cc1ccc(c(c1)c2cc(n[nH]2)C(=O)Nc3nnc(s3)C)O
|
|
315
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
316
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
317
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
318
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
319
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
320
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
321
|
CNc1nc(nc(n1)n2cnc(n2)SC)NC
|
|
322
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
323
|
C=Cn1ccnc1CCOC(=O)c2ccc(cc2)Cl
|
|
324
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
325
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
326
|
c1cc2cn[nH]c2cc1C3=CCOCC3
|
|
327
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
328
|
Cc1ccc2nc(cn2c1)Cn3nc(nn3)c4ccccc4
|
|
329
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
330
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
331
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
332
|
C1CCC2C(C1)[C@@](C(=O)N2)(NC3C(NC(C(N3)C#N)C#N)N)O
|
|
333
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
334
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
335
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
336
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
337
|
Cc1ncc(s1)CN(C)[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
338
|
c1ccc(cc1)/C=C/[C@@H](O)S(=O)(=O)[O-]
|
|
339
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
340
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
341
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
342
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
343
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
344
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
345
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
346
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
347
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
348
|
CCOC(=O)[C@@H]1CCC(=N1)c2ccc[nH]2
|
|
349
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
350
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
351
|
C1CCC(CC1)[C@@H]2CC(=NS(=O)(=O)N2)C3CCCCC3
|
|
352
|
c1ccc(cc1)Nc2ccccn2
|
|
353
|
c1ccc(c(c1)[C@H]2[C@@H](CCC(=O)N2)NCC3=COCCO3)F
|
|
354
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
355
|
COC(=O)c1c(=O)n([nH]n1)Cc2cccs2
|
|
356
|
c1ccc(cc1)CNc2cnccn2
|
|
357
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
358
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
359
|
c1cnc(nc1c2nccs2)N
|
|
360
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
361
|
Cc1ccc(cc1)NC(=O)c2nnc(s2)Cn3ccnc3
|
|
362
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
363
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
364
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
365
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
366
|
|
|
367
|
CCC(=O)Nc1cnn(c1)Cc2nnnn2CCOC
|
|
368
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
369
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
370
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
371
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
372
|
Cc1c(nn(n1)C(=O)c2ccccc2)C
|
|
373
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
374
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
375
|
Cc1ccc(cc1)c2nnn(n2)c3c4c(c5ccccc5o4)ncn3
|
|
376
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
377
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
378
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
379
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
380
|
CC(=O)O[C@@H]1CC([C@H](O1)OCc2ccccc2)(F)F
|
|
381
|
Cc1c(snn1)C(=O)N=[S@](=O)(C)c2ccccc2
|
|
382
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
383
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
384
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
385
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
386
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
387
|
CC[C@@H](CCC(=O)/N=c/ccn([nH]1)c2ccccc2)C(=O)[O-]
|
|
388
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
389
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
390
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
391
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
392
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
393
|
CCOc1nnc(s1)Cn2c(noc2=O)c3ccccc3
|
|
394
|
CC/C=C(C)/C=C/C/C(=C/[C@@H](C(=O)N1CC[C@@H]([C@@H]1OC)O)O)/C
|
|
395
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
396
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
397
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
398
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
399
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
400
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
401
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
402
|
CCO/C=C/[C@@](CNC(=O)C1CC1)(C(F)(F)F)O
|
|
403
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
404
|
CC1=Nc2c(c(nc(n2)N3CCCCC3)N)C1=O
|
|
405
|
c1ccc(cc1)c2nnn(n2)Cn3c(=O)c4ccccc4nn3
|
|
406
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
407
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
408
|
CCNc1nc(nc(n1)Cl)Sc2nnc(s2)SC
|
|
409
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
410
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
411
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
412
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
413
|
Cc1cc([nH]n1)OCCC#N
|
|
414
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
415
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
416
|
CCOC(=O)Nc1c(n[nH]n1)Cl
|
|
417
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
418
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
419
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
420
|
c1ccnc(c1)SCCn2cccn2
|
|
421
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
422
|
C1CCC(CC1)C(=O)NN2CCNN2
|
|
423
|
Cc1nnc(s1)SCN2CCN(CC2)c3ccccc3
|
|
424
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
425
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
426
|
Cc1nc(cs1)c2ccc[nH]2
|
|
427
|
c1ccnc(c1)Nc2cccs2
|
|
428
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
429
|
C1CCC2C(C1)NC3=C(N2)O[C@@H](C3=O)C4CCCO4
|
|
430
|
Cc1ccc(cc1)[C@@H]2C(=NS(=O)(=O)[N-]2)N
|
|
431
|
CCOc1cc(no1)Oc2ccccc2
|
|
432
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
433
|
c1ccc(cc1)c2ccc(oc2=O)C(=O)c3ccccc3
|
|
434
|
Cc1cc(no1)n2c(c[nH]c2=O)C
|
|
435
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
436
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
437
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
438
|
COC1=CC(=O)O[C@@H](C1)C2CCCO2
|
|
439
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
440
|
COc1ccccc1C/C=C/c2cccs2
|
|
441
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
442
|
CC1(OC[C@@H]([C@@H](O1)[C@@H](C2[NH]C(C(N2)C#N)OC)O)O)C
|
|
443
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
444
|
c1ccc2c(c1)nn(n2)Cc3ccco3
|
|
445
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
446
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
447
|
c1ccc2c(c1)N[C@@H]3CC(=N2)[C@@H]4OC[C@H]3O4
|
|
448
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
449
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
450
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
451
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
452
|
c1ccc(cc1)c2ncc(o2)C3=NCCO3
|
|
453
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
454
|
Cc1ccc(cc1)S(=O)(=O)Oc2nc(cc(n2)C)C
|
|
455
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
456
|
Cc1ccc(cc1)S(=O)(=O)Oc2cc(nn2C)C(F)(F)F
|
|
457
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
458
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
459
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
460
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
461
|
c1cc(oc1)CNc2nnns2
|
|
462
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
463
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
464
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
465
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
466
|
Cc1nnc(s1)SC2=C(Nc3ccccc3NC2=O)C
|
|
467
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
468
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
469
|
c1ccc(cc1)[C@H]2C[C@](N=C(N2)N)(C(F)(F)F)O
|
|
470
|
c1cc2c(cc1C(=O)[O-])N[C@@H](N2)C(F)(F)F
|
|
471
|
CC(=O)NSC[C@@H](C(=O)[O-])NC(=O)OC(C)(C)C
|
|
472
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
473
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
474
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
475
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
476
|
Cc1c(c(on1)C)COn2c3cc(ccc3nn2)C(F)(F)F
|
|
477
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
478
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
479
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
480
|
|
|
481
|
CCOc1/c(=N/Cc2ccccc2)/c(=O)c1[O-]
|
|
482
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
483
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
484
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
485
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
486
|
CC(=O)O/C=C/c1ccccc1
|
|
487
|
Cc1cc(=O)n2c(n1)sc(n2)Cn3nc(nn3)c4ccccc4
|
|
488
|
Cc1cc(c(o1)C)c2cnnc(n2)N3CC[C@@H](C3)COC
|
|
489
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
490
|
CCCCc1[nH]cc([nH+]1)CO
|
|
491
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
492
|
c1ccc(cc1)C2=NC(=O)CN2
|
|
493
|
Cc1cnc(o1)COc2ccccc2
|
|
494
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
495
|
C1CC[C@@H]2[C@@H](C1)NC(=O)C(=N2)CCC(=O)[O-]
|
|
496
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
497
|
|
|
498
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
499
|
CCn1cc(cn1)c2cc[nH]n2
|
|
500
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
501
|
C1CC(C(=O)N(C1)CC2NNC(O2)C3CC3)C(F)(F)F
|
|
502
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
503
|
Cc1c(nn(n1)c2ccccc2)C(=O)n3cccc3
|
|
504
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
505
|
CC#CCCCCCCC#CC
|
|
506
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
507
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
508
|
Cc1c(non1)NS(=O)(=O)c2ccccc2
|
|
509
|
CC(C)CN1N(O1)CCOC(=O)NC2CCCCC2
|
|
510
|
CC(=O)Nc1nnc(s1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
511
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
512
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
513
|
Cc1c(cc2c(n1)nc(o2)[O-])c3ccncc3
|
|
514
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
515
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
516
|
COC(=O)Nc1cn2c(n1)ccc(n2)C(=O)N
|
|
517
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
518
|
C[C@@H](N1CCNC1)OCCCC2CCCCC2
|
|
519
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
520
|
c1ccc(cc1)[C@H]2[C@H]([C@H]3[C@@H](O2)CC(=O)O3)O
|
|
521
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
522
|
c1ncn(n1)NCNn2cncn2
|
|
523
|
CC#CC(=O)COC/C(=C/C=C)/C
|
|
524
|
Cc1cnc(s1)Nc2cnc(nc2)SC
|
|
525
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
526
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc2nccs2)[O-]
|
|
527
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
528
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
529
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
530
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
531
|
CC1=N[C@H](C(=O)C1)c2ccccc2
|
|
532
|
c1ccc(cc1)c2cc3nc(c4c(n3n2)nc(o4)c5ccccc5)N
|
|
533
|
Cc1ncc(s1)CN(C)Cn2c(=O)oc(n2)c3ccccc3
|
|
534
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
535
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
536
|
C1CCC(CC1)C(=O)N[C@@H]2C(=O)NN=C2[O-]
|
|
537
|
CN(CCn1cccn1)c2ccccc2
|
|
538
|
CS(=O)(=O)NCCOc1cc(ncn1)N2CCCC2
|
|
539
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
540
|
Cc1c(c2ccccc2n1C)c3cc(n[nH]c3=O)c4ccccc4
|
|
541
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
542
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
543
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
544
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
545
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
546
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
547
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2cccn2C)[O-]
|
|
548
|
Cc1cc(nc(n1)n2c(c(c(=O)c(n2)C)c3ccccc3)N)C
|
|
549
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
550
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
551
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
552
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=NC(=N2)N3CCOCC3)[O-]
|
|
553
|
c1ccc(cc1)C(=O)NCn2cncn2
|
|
554
|
c1cc(cnc1)CCNCc2cscn2
|
|
555
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
556
|
c1ccc(cc1)[C@H]2[C@H](C(=O)N2)O
|
|
557
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
558
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
559
|
|
|
560
|
Cc1nc2c(n1C)CCN(C2)C[C@@H](c3ccc(cc3)OC)O
|
|
561
|
c1ccc2c(c1)CC(C2)(C#N)O[C@@H]3CCCCO3
|
|
562
|
c1cc2c(nc1)S[C@@H](NC2=O)c3ccco3
|
|
563
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
564
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
565
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
566
|
Cn1c(cc(n1)C(=O)OC)OC(=O)C23CC4CC(C2)CC(C4)C3
|
|
567
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
568
|
Cc1c(c(n(n1)c2ccccc2)C)c3nc(no3)c4ccccc4
|
|
569
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
570
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
571
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
572
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
573
|
CN(C)C1NC(SN1)C(=O)C2C[NH]C3C2CCCC3
|
|
574
|
c1ccc(cc1)N2CCN(CC2)Cc3nnnn3Cc4ccco4
|
|
575
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
576
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
577
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
578
|
Cc1ccc(cc1)/C=C/2C(=O)C(=C(N2)C)C(=O)OC
|
|
579
|
COC(=O)N1CCC(CC1)c2cc(=O)[nH]s2
|
|
580
|
c1ccc(cc1)c2nnn(n2)CCS(=O)(=O)N3CCOCC3
|
|
581
|
|
|
582
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
583
|
Cc1c(oc(c1C#N)NC(=O)CN2CCOCC2)C
|
|
584
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
585
|
c1ccc(cc1)CNn2cnnn2
|
|
586
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
587
|
CCOc1cc(c(o1)C)c2ccccc2
|
|
588
|
CCOC(=O)c1c(ocn1)[C@@H]2COC(O2)(C)C
|
|
589
|
COc1cccc(c1)C2=CCN(CC2)Cn3cnc(n3)C(=O)OC
|
|
590
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
591
|
Cn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
592
|
CCCC(=O)OCOC(=O)/C=C(C)/N
|
|
593
|
CCOC(=O)CC/C=C/C#C
|
|
594
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
595
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
596
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
597
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
598
|
c1ccc(cc1)c2ncc(o2)c3ncco3
|
|
599
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
600
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
601
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
602
|
Cc1csc(n1)c2cn[nH]c2N
|
|
603
|
CC(=O)N1CCC(=CC1)c2c[nH]c3c2cccn3
|
|
604
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
605
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
606
|
Cc1[nH]nc(n1)c2ccccc2
|
|
607
|
CCO/C=CCC1(CCCC1)O
|
|
608
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
609
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
610
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
611
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
612
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
613
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
614
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
615
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
616
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
617
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
618
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
619
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
620
|
c1ccc(cc1)C#CCS(=O)(=O)[O-]
|
|
621
|
CCOC(=O)c1cc(no1)c2c(non2)N3CCOCC3
|
|
622
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
623
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
624
|
c1ccc(cc1)C2=NCCNC(=O)C2
|
|
625
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
626
|
CCOC(=O)N=[S@@](=O)(c1ccccc1)N
|
|
627
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
628
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
629
|
CC1=CC(=O)O[C@@]1(CC(=O)C2CCCCC2)O
|
|
630
|
C1N=C(N=C2N1[C@H]3[C@@H](O2)[C@@H]([C@@H](O3)CO)O)N
|
|
631
|
Cn1c(cc(n1)C(=O)OC)OC(=O)c2ccco2
|
|
632
|
|
|
633
|
Cc1nc([nH]n1)/N=C(/N2CCc3cc(c(cc3C2)OC)OC)[O-]
|
|
634
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
635
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
636
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
637
|
COC(=O)c1c(cc(s1)n2cccn2)O
|
|
638
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
639
|
c1ccc(cc1)NC2=CC(=O)OC2
|
|
640
|
CCc1cccc([o+]1)c2ccccc2
|
|
641
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
642
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
643
|
|
|
644
|
C=CCNc1cn[nH]c(=O)n1
|
|
645
|
Cc1nc(cs1)Cn2c(=O)oc(n2)c3ccc(cc3)F
|
|
646
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
647
|
c1ccn(c1)C2CCN(CC2)CCC#N
|
|
648
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
649
|
|
|
650
|
c1cnc(nc1c2cnccn2)N
|
|
651
|
c1cc(ccc1c2cc(n(n2)C(=O)c3c(n[n-]n3)Cl)N)Cl
|
|
652
|
C/C=C/C[C@@]1(C(=N1)C2CCCCC2)C
|
|
653
|
C1CCC(CC1)C(=O)[C@@H]2C=C[C@@](O2)(C#N)C3CCCCC3
|
|
654
|
C[C@@H]1[C@@H](OCC(=O)N1)C2CCCCC2
|
|
655
|
COCCC/N=C/[C@@H](C(=O)C1=O)NCCO
|
|
656
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
657
|
c1ccc(cc1)NC(=O)Nc2ccno2
|
|
658
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
659
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
660
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
661
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
662
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
663
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
664
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
665
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
666
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
667
|
Cc1cc(no1)c2nnc(o2)N
|
|
668
|
C1CCC(CC1)C2=N[C@@H]3C4CCCCC4[C@H]2O3
|
|
669
|
CS(=O)(=O)NCc1ccccn1
|
|
670
|
Cc1c(ccnc1COc2nc3ccccc3o2)OCC(C)C
|
|
671
|
c1ccc(cc1)Nn2cncn2
|
|
672
|
c1cc(sc1)CCNc2ncccn2
|
|
673
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
674
|
CN1CNNC1CNS(=O)(=O)N2CCCCC2
|
|
675
|
c1ccc(cc1)n2c(c(c(nc2=O)Cn3cncn3)C#N)N
|
|
676
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
677
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
678
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
679
|
CC1CCC(CC1)[C@@H]2C(=N2)C(=O)OC
|
|
680
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
681
|
c1ccn2c(c1)nn(c2=O)CCn3c(noc3=O)c4cccs4
|
|
682
|
C1CC(OC1)CNC2=NCCO2
|
|
683
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
684
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
685
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
686
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
687
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
688
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
689
|
c1cocc1c2nc([nH]n2)N
|
|
690
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
691
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
692
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
693
|
c1ccc(cc1)CCC2=N[C@H](C=C2)C(=O)c3ccc4c(c3)OCO4
|
|
694
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
695
|
Cc1c([nH]n(c1=O)C2=NCCN2)c3ccccc3
|
|
696
|
COc1ccc(cc1)C2=COc3ccccc3C(=O)N2
|
|
697
|
c1ccc(cc1)SC2=C(CC2)Sc3ccccc3
|
|
698
|
CC1NNC(O1)NC(=O)C2CCC(CC2)C#N
|
|
699
|
Cc1cnc(o1)Cn2cccn2
|
|
700
|
COC(=O)CC/C(=C/1C(=O)CC(=N1)c2ccccc2)/[O-]
|
|
701
|
c1cc(sc1)c2ccn[nH]2
|
|
702
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
703
|
c1ccc(cc1)c2nnc(o2)Cn3c4ccccc4sc3=O
|
|
704
|
C1CCC(CC1)SC[C@@]2(CCCC=C2)O
|
|
705
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
706
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
707
|
c1ccc(cc1)c2cc(=O)c2=O
|
|
708
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
709
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
710
|
Cc1ccc(cc1)S(=O)(=O)[N-]c2cc([nH]n2)C
|
|
711
|
c1ccc(cc1)C2=NC(=O)CC(=O)N2
|
|
712
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
713
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
714
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
715
|
Cc1ccc(cc1)c2nnc(o2)c3c(cnc(n3)SC)Cl
|
|
716
|
Cc1cc(no1)Cn2cnc3ccccc3c2=O
|
|
717
|
Cn1c(cc(n1)Oc2ccc(cn2)C(F)(F)F)C(F)(F)F
|
|
718
|
c1cc(sc1)C2=CC[C@@H](C(=O)N2)C#N
|
|
719
|
c1ccc(cc1)c2nn(c(=O)o2)CN3CCOCC3
|
|
720
|
c1nc([nH]n1)c2c(non2)N
|
|
721
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
722
|
c1ccnc(c1)c2cn(nn2)C3CCN(CC3)C(=O)C4CC4
|
|
723
|
Cc1cc(=O)c(c(o1)Nc2ccccc2)C(=O)C
|
|
724
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
725
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
726
|
c1cc(n[nH]c1=O)NC2CC2
|
|
727
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
728
|
COC(=O)C[C@@H]1Cn2c(nc(n2)C(F)(F)F)N=C1[O-]
|
|
729
|
c1c2c(nc(nc2oc1C(=O)[O-])C(F)(F)F)[O-]
|
|
730
|
CC(C)(C)OC(=O)N1CC[C@@](C1)(CSc2ccncc2)O
|
|
731
|
COCc1cn(nn1)[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
732
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
733
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
734
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
735
|
c1cc([nH]c1)c2nnc(o2)SCC(F)(F)F
|
|
736
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
737
|
c1ccc2c(c1)N[C@@H](O2)c3cccs3
|
|
738
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
739
|
c1ccc(cc1)CO[C@@H]2C=CC=CO2
|
|
740
|
c1cc(oc1)CNc2[n-]nnn2
|
|
741
|
c1ccc(cc1)NC[C@@H]2COCO2
|
|
742
|
Cc1c(c(n[nH]1)C)[C@@H]2C[C@@H](C=C2)O
|
|
743
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
744
|
Cc1c2ccccc2nc(n1)NC3=N[C@@H](C=C(N3)COC)O
|
|
745
|
C1CCC(CC1)N2CC(=C(C2=O)[O-])C(=O)N
|
|
746
|
Cc1cc2nc(nc(n2n1)N)N
|
|
747
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
748
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
749
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
750
|
Cn1cnn2c1nc(c2)c3ccccc3
|
|
751
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
752
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
753
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
754
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
755
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
756
|
c1ccc(cc1)c2csc(n2)C(C#N)C#N
|
|
757
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
758
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
759
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
760
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
761
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
762
|
c1cnoc1c2nnc(o2)N
|
|
763
|
c1ccc(cc1)[C@@H]2C(=O)NC(=O)O2
|
|
764
|
CC1NC2C(CN(N2)CC3CCCCC3)C(=O)O1
|
|
765
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
766
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
767
|
Cc1csc(n1)Sc2nnc(s2)c3ccccc3
|
|
768
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
769
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
770
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
771
|
c1ccc(cc1)N2Cc3nc(=O)[nH]n3C2=O
|
|
772
|
c1ccc(cc1)c2cc(cc(=O)o2)[O-]
|
|
773
|
Cc1c[nH]/c(=NC(=O)OC(C)(C)C)/[nH]1
|
|
774
|
c1ccc2c(c1)NC(N2)[C@@H]3CCC=CO3
|
|
775
|
c1ccc(cc1)C2=CCNn3cnnc3S2
|
|
776
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
777
|
c1cc(ccc1N2CCC(=C2[O-])C(=O)/N=c/3[nH]ccs3)F
|
|
778
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
779
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
780
|
[H]/N=c/n(c(co1)C)CC(=O)c2ccc(cc2)C
|
|
781
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
782
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
783
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
784
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
785
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
786
|
c1ccc(cc1)c2ccncn2
|
|
787
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
788
|
Cc1ccc(cc1)S(=O)(=O)/N=c/cc([nH]c(=O)[nH]2)[O-]
|
|
789
|
c1ccc2c(c1)[nH]c(=O)c(n2)n3ccnc3
|
|
790
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
791
|
C[C@@H]1[C@@H](OC2CCCCC2O1)NC3=NCCO3
|
|
792
|
c1ccc(cc1)OCCn2ccnc2
|
|
793
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
794
|
Cc1nnc(o1)C(=O)Nc2ccccc2
|
|
795
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
796
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
797
|
c1ccc2c(c1)OC(=Cc3ccco3)O2
|
|
798
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
799
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
800
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
801
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
802
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
803
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
804
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
805
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
806
|
c1cc(nn2c1ncc(c2=O)N)N3CCCC3
|
|
807
|
c1cc(ccc1C2=C/C(=C/3C=C(C=CC3=O)Cl)/ON2)F
|
|
808
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
809
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
810
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
811
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
812
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
813
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
814
|
CCOC(=O)c1[nH]nc(n1)N
|
|
815
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
816
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
817
|
c1cc([nH]c1)/C=N/c2ccc(cc2)F
|
|
818
|
c1cc(cnc1)CNCCc2ccco2
|
|
819
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
820
|
c1ccc(cc1)/C=C/CN2CCC(CC2)C#N
|
|
821
|
CO[C@@H]1C=C[C@@H]2[C@@H](O1)CO[C@@H](O2)c3ccccc3
|
|
822
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
823
|
|
|
824
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
825
|
|
|
826
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
827
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
828
|
COc1ccc(cc1)C(=O)Oc2cc(n(n2)S(=O)(=O)C)N
|
|
829
|
COC(=O)C[C@@H]1Cn2c(ncn2)N=C1O
|
|
830
|
c1ccc(cc1)NCc2ccco2
|
|
831
|
CC(C)(C)c1c/c(=N/S(=O)(=O)N(C)C)/cc[nH]1
|
|
832
|
c1ccc(cc1)CCN2CC3=C(CCCC3=O)NC2
|
|
833
|
c1cn[nH]c1c2ccsc2
|
|
834
|
c1ccc(cc1)NC(=O)/C=c/2c(nc3n2c4ccccc4n3)O
|
|
835
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
836
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
837
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
|
838
|
c1cc(cnc1)NCc2csnn2
|
|
839
|
c1ccc(cc1)NC2=NC(=O)CC(=N2)[O-]
|
|
840
|
|
|
841
|
c1ccc(c(c1)C2=Nc3cncnc3NC2)N
|
|
842
|
C1CCC(CC1)[C@@H]2CC(=O)OC2
|
|
843
|
CC1NC(ON1)CC2CCCS2
|
|
844
|
|
|
845
|
CS(=O)(=O)NCc1ccco1
|
|
846
|
C[C@@]1(COC(=N1)COc2ccccc2)CO
|
|
847
|
c1ccc2c(c1)[nH]c(n2)Nn3cnnc3
|
|
848
|
c1ccc2c(c1)[nH]c(=O)n2c3csc(n3)c4ccncc4
|
|
849
|
CCC(=O)CC/C=C/C#CC#CC#CC
|
|
850
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
851
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
852
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
853
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
854
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
855
|
CCOC(=O)N1CCN(CC1)C2NNC3NCCN3N2
|
|
856
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
857
|
CCCc1nncn1NC(=O)OCC
|
|
858
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
859
|
Cc1[nH]cc(n1)c2ccccc2
|
|
860
|
Cc1ccc(cc1)c2cnco2
|
|
861
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
862
|
C1CC([NH]C1)C(=O)OCC#N
|
|
863
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
864
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
865
|
Cc1c(non1)c2ccn[nH]2
|
|
866
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
867
|
c1ccc(cc1)C2=CCC(=O)O2
|
|
868
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
869
|
|
|
870
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
871
|
CCCCC#C/C=C/COC(=O)C
|
|
872
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
873
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
874
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
875
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
876
|
Cc1c2c(n(n1)c3ccccc3)S[C@@H]2c4ccco4
|
|
877
|
Cc1c(n[nH]c(=O)c1C#N)/C=C/c2cccs2
|
|
878
|
[H]/N=c/n(nc(s1)N2CCOCC2)Cc3ccccc3
|
|
879
|
CCOC(=O)c1ccc2c(c1)[nH]c(c2O)c3ccccc3
|
|
880
|
C[C@@]12CC(=N[C@@H]1NC(=O)C2)c3ccccc3O
|
|
881
|
c1cc(cc(c1)Cl)n2ccc(n2)c3cnccn3
|
|
882
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
883
|
C1CC(OC1)C2CNC3C(N2)C(NC(N3)N)N
|
|
884
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
885
|
C/C(=C/Oc1ccccc1)/C=C/OC
|
|
886
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
887
|
COc1ccc(cc1)/N=c/[nH]c(cc(=O)[nH]2)O
|
|
888
|
c1ccc(cc1)c2ccc(=O)on2
|
|
889
|
c1ccc2c(c1)NC3(S2)NC(=O)C(=O)C(=O)N3
|
|
890
|
c1ccc(cc1)S(=O)(=O)[C@@H]2CC(=O)N2
|
|
891
|
Cc1cc(ncn1)Nc2ccccc2
|
|
892
|
c1ccc(cc1)N2CCC(=O)C2
|
|
893
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
894
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
895
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
896
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
897
|
c1ccc(cc1)S(=O)(=O)C[C@@H]2CSc3n2ncn3
|
|
898
|
c1ccn(c1)c2[n-]c(nn2)C(=O)[O-]
|
|
899
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
900
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
901
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
902
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
903
|
c1cnnc(n1)c2nccnn2
|
|
904
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
905
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
906
|
CCOc1nc(nc(n1)N)C
|
|
907
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
908
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
909
|
c1cc(cnc1)C2=NC(=O)C3(N2)CCCC3
|
|
910
|
CCOC(=O)/C=C/1[C@@](C2CCCCC2O1)(C)O
|
|
911
|
CS(=O)(=O)NCCOc1ccccc1
|
|
912
|
c1c[nH]nc1c2nccs2
|
|
913
|
C[S@@](=NC(=O)c1ccccc1)(=O)c2ccsc2
|
|
914
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
915
|
c1cscc1c2cnc(c(n2)N3CCC[C@@H](C3)CCCO)N
|
|
916
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
917
|
CS(=O)(=O)Nc1ccccn1
|
|
918
|
|
|
919
|
c1cc(oc1)/C=c/2c(=O)[nH]/c(=Cc3ccco3)/c(=O)[nH]2
|
|
920
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
921
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
922
|
Cc1nc2c(ncnc2o1)N
|
|
923
|
CC(C)CC(=O)C[C@@]1(CC[C@@H](O1)C2CCOC2)C
|
|
924
|
c1ccc2c(c1)C(=O)C(C2=O)(c3c([nH]c(=O)[nH]c3=O)[O-])O
|
|
925
|
c1ccc(cc1)c2nc(cc(=O)o2)[O-]
|
|
926
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
927
|
CN(C)C(=O)n1c(nnn1)Cc2ccc(cc2)c3ccccc3
|
|
928
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
929
|
C1CCC(CC1)S(=O)(=O)C2=C[C@@H](C[C@@H]2O)O
|
|
930
|
Cc1nc-2n(n1)CC(=Nc3c2cccc3)O
|
|
931
|
c1cc(ncc1C#N)NCc2nccs2
|
|
932
|
CC(C)c1nc([nH]n1)CC#N
|
|
933
|
Cc1c(c[nH]n1)c2ccccc2
|
|
934
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
935
|
c1ccc(cc1)[C@@H]2C(=O)Oc3cccnc3S2
|
|
936
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
937
|
Cn1c(=O)cc([nH]1)c2ccccc2
|
|
938
|
Cn1c(cc(=O)n(c1=O)C)Cn2nc(nn2)c3ccccc3
|
|
939
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
940
|
Cc1c(oc(n1)NS(=O)(=O)c2ccc(cc2)N)C
|
|
941
|
c1ccc(cc1)/C=C/S(=O)(=O)[O-]
|
|
942
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
943
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
944
|
CC1=NC2=NC(=NC(=O)C2=C1Sc3ccccn3)[NH-]
|
|
945
|
c1ccc(cc1)CCOn2ccnc2
|
|
946
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
947
|
c1ccc(cc1)c2cn(c(=O)o2)c3ccccc3
|
|
948
|
c1cc(oc1)COCCC#N
|
|
949
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
950
|
c1ccc(cc1)CC2=CC(=O)[C@H](C=N2)[O-]
|
|
951
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
952
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
953
|
COC1=COC(=C(O1)O)C2CCC(CC2)F
|
|
954
|
CCOC(=O)C1=C(C(=O)N(C1)c2ccccc2)N
|
|
955
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
956
|
[H]/N=c/n(nc(s1)C)Cc2ccccc2
|
|
957
|
CS(=O)(=O)N1CCN(CC1)CN2CCOC2=O
|
|
958
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
959
|
Cc1nnc(s1)SCC2=NN(C(=O)C2)c3ccccc3
|
|
960
|
CC(C)c1nc(cs1)CNC(=O)c2c(ocn2)C3CC3
|
|
961
|
Cc1ccc(cc1)S(=O)(=O)NC(=O)n2ccnc2C
|
|
962
|
c1ccnc(c1)C2=CCCCC2
|
|
963
|
C[C@@H](C1CCCS1)NC2=NCCO2
|
|
964
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
965
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
966
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
967
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
968
|
CCCCN1CC(=O)N=C1Nc2ccccc2
|
|
969
|
c1c2c(n[nH]1)[C@H]3[C@@H]([C@@H](C2=O)CC3=O)NCCC#N
|
|
970
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
971
|
CCCCS(=O)(=O)c1c(nc(s1)SC)N
|
|
972
|
Cc1ccccc1NC2=NC(=[NH+]C(N2)(C)C)N
|
|
973
|
c1ccc(cc1)CN2CC3(CC[C@@H]2C#N)OCCO3
|
|
974
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
975
|
Cc1nnc2n1nc(n2c3ccccc3)[O-]
|
|
976
|
CC(C)(C)OC(=O)N1CCC(CC1)Cc2cnc[nH]2
|
|
977
|
Cc1c(oc(n1)Cn2nc(nn2)c3ccccc3)C
|
|
978
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
979
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
980
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
981
|
Cn1cc(nc1C(=O)[O-])NC(=O)c2cccs2
|
|
982
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
983
|
CC[C@H](C)[C@@H]1C(=Nc2ccccc2C(=N1)O)O
|
|
984
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
985
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
986
|
CCOc1nnc(s1)CN2CCOCC2
|
|
987
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
988
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
989
|
|
|
990
|
c1cc(oc1)c2nc3c(cc(cn3n2)C(=O)N4CCCC4)N
|
|
991
|
Cc1cc(c(o1)C)c2cc[nH]n2
|
|
992
|
COC(=O)/C=C/C(=O)NCCN1
|
|
993
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
994
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
995
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
996
|
|
|
997
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
998
|
c1ccc(cc1)C2=CC(=O)OC2
|
|
999
|
Cc1cn2c(n1)sc(n2)NCC=C
|
|
1000
|
c1cc(sc1)c2[nH]ccn2
|
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