(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
[H]/N=c/n2c(c(cnc2nn1c3ccccc3)O)C
|
|
2
|
c1cc2c(cc1c3c4ccoc4ccn3)OCCO2
|
|
3
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
4
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
5
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
6
|
c1ccc2c(c1)CN(C(=C2)N)C3CCCCC3
|
|
7
|
Cc1c2c(nc(oc2=O)c3ccccc3Cl)on1
|
|
8
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
9
|
c1ccc(c(c1)N)Nc2c(cn(c(=O)n2)Cc3cccs3)C#N
|
|
10
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
11
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
12
|
c1ccc(cc1)Nc2c(nnn2c3ccccc3)c4ccn[nH]4
|
|
13
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
14
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
15
|
c1ccc2c(c1)nnn2[C@H]3CCC[C@@H]4N3CCn5c4ccc5
|
|
16
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
17
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
18
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
19
|
CSc1nnc(c(=O)n1N)/C=C/c2cccs2
|
|
20
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
21
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
22
|
c1cc(c(cc1Cl)c2cc([nH]n2)C(F)(F)F)O
|
|
23
|
c1ccc2c(c1)C3=NC(=N[C@H]3C2=O)C(=O)c4ccccc4C(=O)[O-]
|
|
24
|
CCN1C(NN2C(C1=O)NC3CCCCC3C2=O)C
|
|
25
|
CC1CC2CC3CCCNN3C2NN1
|
|
26
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
27
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
28
|
CCOC(=O)c1cnc2c3c1onc3CCC2
|
|
29
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
30
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
31
|
CC1CCCCC1NC(=C2C(=O)OC(OC2=O)(C)C)[O-]
|
|
32
|
c1ccc2c(c1)c(=O)n(cn2)Cc3c(snn3)Cl
|
|
33
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
34
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
35
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
36
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
37
|
C1CCC(CC1)NC2=NC3C(CCCC3C(=O)[O-])C2=O
|
|
38
|
c1c(c(c(=O)n(n1)Cc2c(snn2)Cl)Cl)Cl
|
|
39
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
40
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
41
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
42
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
43
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
44
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
45
|
c1ccc(cc1)Sc2c3[nH]ncn3c(=O)nn2
|
|
46
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
47
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
48
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
49
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
50
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
51
|
CC1CC(N2C1[C@@H](CC2)O)C3(C(=O)C4CCCCC4C3=O)O
|
|
52
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
53
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
54
|
Cc1ccccc1n2n(o2)c3ccccc3C
|
|
55
|
Cn1c(=O)c2c(c(n[nH]2)c3ccccc3)[nH]c1=O
|
|
56
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
57
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
58
|
COc1ccccc1/N=c/2cccccc2O
|
|
59
|
c1ccc2c(c1)c(=O)c(c([nH]2)[O-])C(=O)Nc3nccs3
|
|
60
|
C[S@@](=NCn1c2ccccc2nn1)(=O)c3ccccc3
|
|
61
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
62
|
CCCCn1c(c(c2c1ncn(c2=[NH2+])c3nccs3)C)C
|
|
63
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
64
|
COCCn1c(=O)c2c(nn1)scn2
|
|
65
|
Cc1ccc(nc1)N[C@@]2([C@@H](C(=NC2=O)C)C#N)C(F)(F)F
|
|
66
|
C1CCC(CC1)C2C3C4C(CCCN4C(=O)N2)CCC3
|
|
67
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
68
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
69
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
70
|
CCn1cncc1c2nnc3n2cccc3Cl
|
|
71
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
72
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
73
|
c1ccc2c(c1)c(=O)c(=Nc3ccccn3)c2=O
|
|
74
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
75
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
76
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
77
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
78
|
CC1=Nc2c(c(n(n2)c3ccccc3)O)C(=O)CC1
|
|
79
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
80
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
81
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)[nH]n2
|
|
82
|
c1ccc2c(c1)nnn2CN3CSc4c3cccc4
|
|
83
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
84
|
CC1C(C(=O)NC([NH]1)N)N2C(=O)C3CCCCC3NN2
|
|
85
|
Cc1cc(=O)n2c(n1)sc(n2)Sc3ncnn3N
|
|
86
|
CC1(CC2=N[C@@H](N=C2C(=O)C1)c3ccccc3)C
|
|
87
|
Cn1c2c(cn1)c(ncn2)n3cnc4c3cccc4
|
|
88
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
89
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
90
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
91
|
c1ccc(cc1)[N-]S(=O)(=O)CC2=NC(=O)n3cccc3C2=O
|
|
92
|
CC(C)(C)c1ncc(s1)c2nc3c(cccn3)c(n2)[O-]
|
|
93
|
Cc1cc(nc(n1)Nc2c(nn[nH]2)C(=O)C)C
|
|
94
|
c1ccc(cc1)c2c3ccccn3nn2
|
|
95
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
96
|
c1cscc1OC(=O)C2=NC(=O)CC=C2
|
|
97
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
98
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
99
|
c1ccc(cc1)Oc2nc3ccccn3c(=O)n2
|
|
100
|
Cc1cc(n(n1)CSc2ccccc2)C
|
|
101
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
102
|
Cc1cc(ccc1F)C2=C[C@H]3C(=N2)CC(CC3=O)(C)C
|
|
103
|
CC(=O)c1csc(n1)c2ccno2
|
|
104
|
c1ccc2c(c1)c(=O)n-3c(n2)C(=O)c4c3cccc4
|
|
105
|
C1CCC(CC1)C2C(C3N(N2)-C4CCCCC4[C@@H]3CO)O
|
|
106
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
107
|
C1CCC(CC1)NC2CCC3N(C2=O)CCC3
|
|
108
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
109
|
c1ccc2c(c1)C[C@@H]([C@@H]2Sc3ncccn3)O
|
|
110
|
COC(=O)C1=NC(=CC(=O)C1)C(=O)OC
|
|
111
|
CC(=O)Nc1nc(cs1)Cn2c(noc2=O)c3ccccc3
|
|
112
|
c1ccc2c(c1)nn(n2)Cc3nc4ccccc4s3
|
|
113
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
114
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
115
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
116
|
Cc1c(nn2c(=O)c(nnc2n1)C)[O-]
|
|
117
|
c1ccc(cc1)n2cc3cnnc(c3n2)[O-]
|
|
118
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
119
|
CCn1cc2c(n1)c(=O)n(nn2)C3CCCCC3
|
|
120
|
CCOC(=O)C1=C(C[C@@H](N[C@@H]1c2ccccc2)c3ccccc3)N
|
|
121
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
122
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
123
|
c1ccc2c(c1)c(ncn2)N3CCNc4c3cccc4
|
|
124
|
c1ccc2c(c1)c(=O)c(c(s2)N)c3[nH]c4ccccc4n3
|
|
125
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
126
|
CC1([C@@H]2CCC(=C)[C@@H](C2)C(=N1)C(=O)C3C[NH]C4C3CCCC4)C
|
|
127
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
128
|
Cn1cnc2c(c1=O)n(nc2C(=O)[O-])c3ccc(cc3)F
|
|
129
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
130
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
131
|
Cc1nnc(s1)c2cc3ccccc3n2C
|
|
132
|
CNC(=O)Nc1c2ccccc2nnn1
|
|
133
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
134
|
c1cc(ccc1C(F)(F)F)Nc2c3ccncc3on2
|
|
135
|
CC1NC2C(NCNC2NN1)N
|
|
136
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
137
|
Cc1cc(c(c(=O)o1)Cc2cc(c3cccnc3c2O)Cl)O
|
|
138
|
Cc1cc(ncn1)Nc2ccccc2
|
|
139
|
|
|
140
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
141
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
142
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
143
|
c1cc(nn2c1ncc(c2=O)N)N3CCCC3
|
|
144
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
145
|
c1ccc2c(c1)C(=O)O[C@@]3(N2C(=O)[C@@H]4[C@@H]3[C@H]5C[C@@H]4C=C5)O
|
|
146
|
Cc1ccc(nc1)n2cnnn2
|
|
147
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
148
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
149
|
c1ccc(cc1)c2nn3c(=O)c4ccccc4nc3o2
|
|
150
|
c1ccc(cc1)c2ccc(oc2=O)C(=O)c3ccccc3
|
|
151
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
152
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
153
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
154
|
COc1c2ccoc2c(c(c1c3cc(n[nH]3)C(F)(F)F)O)OC
|
|
155
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
156
|
c1ccc(cc1)n2c3c(cn2)c(nnn3)[O-]
|
|
157
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
158
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
159
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
160
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
161
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
162
|
CC1CCC(CC1)S(=O)(=O)C2CN[NH]N2
|
|
163
|
Cc1c(n[nH]c(=O)c1C#N)/C=C/c2cccs2
|
|
164
|
CSc1cnc2ccccc2n1
|
|
165
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
166
|
Cc1cn2c(nc(nc2n1)c3ccccc3)N
|
|
167
|
CCN1CNNC1C2C3CCCCC3SN2
|
|
168
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
169
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
170
|
Cc1c(nc2c(n1)cccn2)C
|
|
171
|
C[C@]1(c2ccccc2O[C@H]1n3c4ccccc4nn3)CO
|
|
172
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
173
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
174
|
C1CCC(CC1)C2NNC(O2)C3C4CCCCC4SN3
|
|
175
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
176
|
C[C@@H](c1nc2ccccc2o1)n3c4ccccc4nn3
|
|
177
|
c1ccc2c(c1)nnn2C3=NCCCC3
|
|
178
|
c1ccc(cc1)C(=O)c2c3ccccn3nn2
|
|
179
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
180
|
CC1(Cc2c(nc(c(n2)N)C(=O)OC)CO1)C
|
|
181
|
CN1c2ccccc2[C@@](C1=O)(c3nnc(o3)c4ccccc4)O
|
|
182
|
c1ccc-2c(c1)-c3c2nc4ccccc4n3
|
|
183
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
184
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
185
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
186
|
c1ccc(cc1)[C@H]2C(=O)NN=C2[O-]
|
|
187
|
CCc1cc2c(cc1O)occ(c2=O)n3ccccc3=O
|
|
188
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
189
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
190
|
c1c[nH]nc1C(=O)NC2CC2
|
|
191
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
192
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
193
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
194
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
195
|
c1ccc2c(c1)nc(o2)n3c4ccccc4oc3=O
|
|
196
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
197
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
198
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
199
|
Cc1c(c([nH]n1)n2cccc2)C(=O)[O-]
|
|
200
|
Cc1c(cno1)c2cn3ccccc3n2
|
|
201
|
COc1cc(=O)nc(o1)c2ccco2
|
|
202
|
c1ccc2c(c1)nnn2c3nc4ccccc4s3
|
|
203
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
204
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
205
|
Cc1cc(no1)Cn2cnc3ccccc3c2=O
|
|
206
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
207
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
208
|
CCCCCCC1CN[NH]N1
|
|
209
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
210
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
211
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
212
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
213
|
Cc1nnc2n1nc(n2c3ccccc3)[O-]
|
|
214
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
215
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2ncn3c4ccccc4)O
|
|
216
|
|
|
217
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
218
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
219
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
220
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
221
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
222
|
Cc1cc(=O)n2c(n1)nc(c(n2)C)[O-]
|
|
223
|
Cc1c(c2c(=O)[nH]cnc2s1)S(=O)(=O)N3CCCCC3
|
|
224
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
225
|
Cc1c2cnnc(c2c(n1C)C)Sc3ccc(cc3)Cl
|
|
226
|
c1cc(c(nc1)c2ccco2)N
|
|
227
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
228
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
229
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
230
|
Cc1cc2nc(cc(=O)n2o1)N(C)Cc3ccsc3
|
|
231
|
C[C@@H](c1ccccc1)N(C)Cc2nccn2C
|
|
232
|
Cc1ccnn1CC/N=c/c(=N/CCCOC)/c(c2O)O
|
|
233
|
c1ccc(cc1)c2nc(cc(=O)o2)[O-]
|
|
234
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
235
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
236
|
Cc1cc(c(c(c1)C)OS(=O)(=O)Nc2cccnc2)C
|
|
237
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
238
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
239
|
|
|
240
|
Cc1c(nnn1c2nccs2)C(=O)[O-]
|
|
241
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2cccs2
|
|
242
|
c1ccc2c(c1)nn(n2)[C@@H](c3ccco3)C(=O)c4cccs4
|
|
243
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
244
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
245
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
246
|
c1cc(oc1)Cn2c(=O)c3cnc(nc3nc2[O-])n4ccnc4
|
|
247
|
C1Cc2c(onc2c3c4c(on3)CCC4)C1
|
|
248
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
249
|
COC(=O)c1c2c(n3cnnc3n1)OCC2
|
|
250
|
c1cn(nc1CC(C(F)(F)F)(C(F)(F)F)O)C(=O)N
|
|
251
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
252
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
253
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
254
|
C[C@@H]1CCCC2=C1[C@@H](C3C(CCCC3N)[C@@H]2O)O
|
|
255
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
256
|
CN1C2C(C(=O)N(C1=O)C)NC3C4CCCCC4OC3N2
|
|
257
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
258
|
Cc1cc(nc2c1c(c(o2)C(=O)C)N)C
|
|
259
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
260
|
CC1(C(=Cc2c(nc3ccccc3n2)O1)OC)C
|
|
261
|
c1ccc(cc1)C(=O)[C@H](C#N)C2=NCCC2
|
|
262
|
C1CCC(CC1)C(=O)/C(=C/2NN=C3N2CCCCC3)/C#N
|
|
263
|
[H]/N=c/n(c(c(s1)C2=c3ccccc3=NC2=O)O)C
|
|
264
|
c1ccc(cc1)C#CNCCOc2ccccn2
|
|
265
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
266
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
267
|
Cc1cc(c(c(c1)O)c2c(c[nH]n2)c3nc(cs3)C)O
|
|
268
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
269
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
270
|
Cc1csc(=O)n1CC(=O)ncccc/c2=NC(C)C
|
|
271
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
272
|
Cc1c(sc(n1)Cn2cnc(c2Cl)Cl)C(=O)C
|
|
273
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
274
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
275
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
276
|
c1ccc2cc(ccc2c1)Nc3ccc(cc3)O
|
|
277
|
c1ccc(cc1)c2cc3c(nccn3n2)Cl
|
|
278
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
279
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
280
|
c1ccc2c(c1)nc3c(n2)Oc4ccccc4N3
|
|
281
|
Cc1nc(no1)CSc2nncs2
|
|
282
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
283
|
c1ccc(cc1)c2c3ccoc3cnc2n4c5ccccc5nn4
|
|
284
|
CCN(CC)C1C(NNC2N1NC3C2CCCN3)C
|
|
285
|
c1cnn(c1)c2cncc(n2)Cl
|
|
286
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
287
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
288
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
289
|
c1ccc2c(c1)[C@@H]3Cc4cccnc4[C@]2(C3)O
|
|
290
|
c1ccc(cc1)[C@@H]2C(=N2)c3ccccc3
|
|
291
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
292
|
CCOC(=O)c1nc2c(s1)NCCCC2
|
|
293
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
294
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
295
|
COC(=O)Oc1c(c2c(s1)nc3ccccc3n2)N
|
|
296
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
297
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
298
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
299
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
300
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
301
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
302
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
303
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
304
|
Cc1cc2c(cc1C)n(cn2)c3c(=O)n(c(=O)n(n3)C)C
|
|
305
|
c1ccc(cc1)c2c(cc(=O)[nH]n2)[O-]
|
|
306
|
CC1(Cc2c(c(n[nH]2)/C=C/c3ccccc3)C(=O)C1)C
|
|
307
|
CN1CC(=C(C1=O)O)c2ccc(cn2)Cc3ccc(cc3)F
|
|
308
|
CN1C(=O)C(C(CN1)SC2NC3CCCCC3S2)CL
|
|
309
|
c1ccc(cc1)S(=O)(=O)[N-]c2cccnc2
|
|
310
|
c1ccc2c(c1)c(=O)c(=N[C@@H]3[C@@H](c4ccccc4C3=O)O)c2=O
|
|
311
|
C[C@@H]1C=C([C@H]2C(=N[NH+]=C2N1)c3ccccc3)C
|
|
312
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
313
|
Cc1cc(nc2c1c(n[nH]2)S(=O)(=O)N3CCC(CC3)C)C
|
|
314
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
315
|
COC1=C(C(=O)O[C@@H]2[C@@H]1C=CC=C2)Cc3ccccc3
|
|
316
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
317
|
C12C(NC(C(N1)CL)CL)SC(N2)C(F)(F)F
|
|
318
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
319
|
c1c(c(n2c(n1)ncn2)[O-])n3cncn3
|
|
320
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
321
|
Cc1ccc(nc1C)c2ccoc2
|
|
322
|
Cc1ccc(cc1)/N=C/c3cccc(c3NC2=O)C
|
|
323
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
324
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
325
|
CC1(CC(=O)C2C3CCCCC3SC2O1)C
|
|
326
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
327
|
C1CCC(C(C1)C2=C/C(=C/3C=CC=CC3=O)/C=NN2)O
|
|
328
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
329
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
330
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
331
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
332
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
333
|
Cc1c(non1)c2cn3cc(ccc3n2)Br
|
|
334
|
c1ccc2c(c1)ccn2Cc3cnc(s3)Cl
|
|
335
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
336
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
337
|
CN1CCn2ccc3c2c1nc(=O)[nH]3
|
|
338
|
c1ccc2c(c1)c(no2)/C=C/c3ccncc3
|
|
339
|
CC(C)(C)OC(=O)N1CCCC(=O)c2c1nn(c2)C
|
|
340
|
c1cc2c(nc1)n(nn2)[O+]=C(N)N
|
|
341
|
CC1CNC(S1)/N=C/2N(CC(S2)C)C3NCC(S3)C
|
|
342
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
343
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
344
|
c1ccc2c(c1)c3c([nH]2)nc4c(n3)non4
|
|
345
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
346
|
CN1c2ccccc2C3(C1=O)[NH+]=c4ccccc4=[NH+]3
|
|
347
|
CC1([C@@H]2CC[C@]1(c3c2nc(c(n3)C#N)C#N)C(=O)[O-])C
|
|
348
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
349
|
CC(C)(C)c1cc2n(n1)C3=NCCN3C=N2
|
|
350
|
|
|
351
|
c1ccc2c(c1)cnn(c2=O)Cc3ccon3
|
|
352
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
353
|
CO[C@@]12CCC(=O)N1C=CC3C2[NH]C4C3CCCC4
|
|
354
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
355
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
356
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
357
|
c1ccc2c(c1)Cc3cccnc3O2
|
|
358
|
CNc1nnc(s1)Sc2nnc(s2)NC
|
|
359
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
360
|
Cc1c(cco1)c2nc3ccccc3s2
|
|
361
|
CC1(CC(=C(C(=O)C1)C2=NCCC2)[O-])C
|
|
362
|
CCNc1nn2c(=O)cc(nc2s1)C
|
|
363
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
364
|
Cc1ccc2c(c1)nc3c(n2)sc(=O)s3
|
|
365
|
C[C@@H]1CC=CCN(C1)S(=O)(=O)c2ccccn2
|
|
366
|
Cc1nc(c(o1)n2cnc3c2cccc3)C#N
|
|
367
|
C/C(=Nc1ccccc1)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
368
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
369
|
C1NC2C(S1)C(=O)[NH]C(N2)N
|
|
370
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
371
|
Cc1c(cco1)c2nnc(n2C)SC
|
|
372
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
373
|
Cc1cc2n(n1)C(=O)CC(=O)C2
|
|
374
|
c1ccc(cc1)c2cccnn2
|
|
375
|
Cc1csc(n1)SCC2=NS(=O)(=O)c3ccccc3N2
|
|
376
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
377
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
378
|
|
|
379
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
380
|
c1ccc(cc1)n2c3ccsc3cn2
|
|
381
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
382
|
|
|
383
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
384
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
385
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
386
|
c1cc(nnc1n2cnnn2)Cl
|
|
387
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
388
|
c1cc(ccc1c2c(c[nH]n2)N3C=CCCC3=O)Cl
|
|
389
|
c1ccc2c(c1)-c3cccnc3C2=O
|
|
390
|
c1ccc(c(c1)C2=Nc3cncnc3NC2)N
|
|
391
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
392
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
393
|
c1cc(ccc1C(=O)c2nnc(s2)Cl)Cl
|
|
394
|
COc1ccc(c(c1)O)c2c(cn[nH]2)c3ccccc3OC
|
|
395
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
396
|
CSc1nnc(o1)Cn2cnc(c2Cl)Cl
|
|
397
|
CCOc1ccc2c(nc(nc2c1)/N=C/NCCC(=N3)[O-])C
|
|
398
|
Cc1c(oc(c1C#N)NC(=O)CN2CCOCC2)C
|
|
399
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
400
|
COC(=O)n1c(=O)c2ccccc2o1
|
|
401
|
c1ccc(cc1)NC(=O)c2ccccn2
|
|
402
|
Cc1nnnn1c2cc3c(s2)CCCC3
|
|
403
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
404
|
CCn1c2ccccc2nc(c1=O)[C@H]3c4ccccc4NC3=O
|
|
405
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
406
|
CC1=N/C(=C/c3ccccc3C(=O)O2)/C(=O)O1
|
|
407
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
408
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
409
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
410
|
c1ccc(cc1)/C=C/c2cc(cc(=O)o2)[O-]
|
|
411
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
412
|
CC1=C[C@@H](c2c1nc3ccccc3n2)c4cnc5ccccc5n4
|
|
413
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
414
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
415
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
416
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
417
|
CCOC(=O)Cn1c(noc1=O)Cc2ccccc2
|
|
418
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
419
|
COc1ccccc1N2CCN(CC2)[C@@H]3CCc4c(cc[nH]4)C3=O
|
|
420
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
421
|
C1CCC2C(C1)C=CC23C(=O)C4CCCCC4C3=O
|
|
422
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
423
|
CCC(=O)c1cc(c(c(c1)Sc2cccc3c2nccc3)O)C
|
|
424
|
c1cnnc(n1)c2nccnn2
|
|
425
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
426
|
Cc1c(oc(n1)Cn2c(=O)c3ccccc3nn2)C
|
|
427
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
428
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
429
|
Cc1ccc(cc1)Nc2[nH+]c(=O)cc(s2)C
|
|
430
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
431
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
432
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
433
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
434
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
435
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
436
|
|
|
437
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
438
|
C1Cc2c(nc(nc2c3c4c(nc(n3)N)CCC4)N)C1
|
|
439
|
C1CCC(CC1)N2CC(=C(C2=O)[O-])C(=O)N
|
|
440
|
c1cc(sc1)C(=O)/C=C/2C(=O)NCCN2
|
|
441
|
c1ccc(cc1)n2c3=CNc4ccccc4N=c3[nH]c2=O
|
|
442
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
443
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(c(nc3=O)[O-])C#N
|
|
444
|
c1ccc(cc1)c2c3n(cn2)CCCCC3
|
|
445
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Nc3ccc4c(c3)OCO4
|
|
446
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
447
|
C1CC(C(=O)N(C1)CC2NNC(O2)C3CC3)C(F)(F)F
|
|
448
|
c1cc(ccc1OC=CNN/C2=C/3C=CC(=O)C=C3[O-])F
|
|
449
|
Cc1ccc(cc1)C2=Nn3c(c(nn3)C)SC2
|
|
450
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
451
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
452
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
453
|
c1ccc(cc1)S(=O)(=O)N2C=Cc3ccccc3[C@@H]2C#N
|
|
454
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
455
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
456
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
457
|
c1ccc(cc1)S(=O)(=O)Nc2ccon2
|
|
458
|
c1ccc2c(c1)nc(o2)c3nc4ccccc4s3
|
|
459
|
c1ccc2c(c1)[C@@H](C(=O)N2)c3c(cc(cn3)C(F)(F)F)Cl
|
|
460
|
c1ccc2c(c1)C(=O)C(C2=O)(c3c([nH]c(=O)[nH]c3=O)[O-])O
|
|
461
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
462
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
463
|
c1ccc(cc1)N=c2c(=O)c3ccccc3c2=O
|
|
464
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
465
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
466
|
c1ccc(cc1)OCCn2ccnc2
|
|
467
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
468
|
c1cc(ccc1[C@@H]2C=Cc3cc(cnc3O2)Cl)Cl
|
|
469
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
470
|
c1ccc(cc1)NC(=O)c2[n-]ncn2
|
|
471
|
Cc1csc(n1)c2c(non2)N
|
|
472
|
c1ccc(cc1)Cc2cc(=O)c(c[nH]2)C(=O)N
|
|
473
|
c1cc(cnc1)C(=O)c2c3c(ccs3)nc(n2)C(F)(F)F
|
|
474
|
c1ccc2c(c1)CCC(=C2)S(=O)(=O)N
|
|
475
|
Cc1ccc(cc1)S(=O)(=O)n2ccc3c2C(=O)[C@@H](C3)C
|
|
476
|
c1ccc(cc1)c2c(cno2)c3nnnn3c4ccccc4
|
|
477
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
478
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
479
|
c1cc(oc1)c2csc3c2c(=O)[nH]cn3
|
|
480
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
481
|
c1c[nH]nc1Nc2c(nc(c(n2)Cl)Cl)Cl
|
|
482
|
c1ccc2c(c1)nnn2CCS(=O)(=O)N3CCCC3
|
|
483
|
CN1CN(C(=O)C2C1NC(N2OC)C3CCCCC3)C
|
|
484
|
c1ccc(cc1)C2=Nc3c(non3)NC=C2
|
|
485
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
486
|
Cc1c(nc2ccccc2n1)c3cscn3
|
|
487
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
488
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
489
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
490
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
491
|
CC(=O)N1CCCn2c1nnc2SC
|
|
492
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
493
|
COC(=O)C[C@@]1(C(=C(C(=N1)[O-])N)C(=O)OC)C(=O)OC
|
|
494
|
Cc1ccc(cc1)C2=Cc3ccccc3NC=C2
|
|
495
|
c1c(nc(cn1)Cl)n2cncn2
|
|
496
|
c1ccc(cc1)S(=O)(=O)Nc2cc3cnnn3c(n2)N
|
|
497
|
c1ccc(cc1)[C@@H]2c3nnnn3-c4ccccc4C2=O
|
|
498
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
499
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
500
|
c1ccc(cc1)c2cn(nn2)c3ccccc3
|
|
501
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
502
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
503
|
c1ccc2c(c1)[nH]/c(=N/C3=NC(=O)C[C@@H](N3)C(=O)[O-])/s2
|
|
504
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
505
|
c1cnccc1N2C(=O)C3=C(S2(=O)=O)CCCC3
|
|
506
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
507
|
|
|
508
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
509
|
c1coc(c(c1=O)O)[C@@]2([C@@H]3C[C@@H]([C@@H](O3)CC2=O)C#N)O
|
|
510
|
C1CC(NNC1)/C=C/C2CCCO2
|
|
511
|
CCC1(C(=O)NC(=Nc2cccc(c2)OC)NC1=O)CC
|
|
512
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
513
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
514
|
Cc1c(c(nc(c1Cl)C)S(=O)(=O)n2ccnc2)C#N
|
|
515
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
516
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
517
|
c1ccc(cc1)S(=O)(=O)CC2=Nc3cccn3C2=O
|
|
518
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
519
|
Cc1c2cc(cnc2n(n1)C)[N-]S(=O)(=O)c3cccs3
|
|
520
|
CCOC(=O)C1=C(C(=O)N(C1)c2ccccc2)N
|
|
521
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
522
|
Cc1cc(no1)CSc2nncs2
|
|
523
|
Cc1ccc2c(c1)C(=O)C[C@@H](O2)c3ncc(n3C)Cl
|
|
524
|
c1ccc2c(c1)C(=O)N3c4ccccc4S[C@@H]3N2
|
|
525
|
CCCCS(=O)(=O)c1c(nc(s1)SC)N
|
|
526
|
c1ccc(cc1)c2ccc(=O)on2
|
|
527
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
528
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
529
|
Cc1nc(n(n1)CCNC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
530
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
531
|
COc1ccc(cc1)C2=NCCc3c2ccs3
|
|
532
|
Cc1cc(=O)n(c(c1C#N)[O-])Nc2ccccc2
|
|
533
|
CCOC(=O)[C@@H]1[C@@](C(=NC(=O)N1)[O-])(C)Br
|
|
534
|
C[C@@H]1C=C[C@@H]([S@@](=O)N1C(=O)CC2CCCCC2)C
|
|
535
|
CCCc1c(c(n(n1)C)[O-])C(=O)c2cc3ccccc3s2
|
|
536
|
c1cc(ccc1n2c(=O)n3c(n2)NCCC3)F
|
|
537
|
CCn1cc(cn1)c2cc[nH]n2
|
|
538
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
539
|
Cc1cc(=O)n2c(c1c3ccccc3)SC[C@@H]2C(=O)[O-]
|
|
540
|
CC(=O)Nn1c2ccccc2nn1
|
|
541
|
c1ccc2c(c1)C=Nc3c(ncnc3O2)N4CCOCC4
|
|
542
|
C1CC(CCC1CC2CC(=O)C3C(S2)CCS3)F
|
|
543
|
c1ccc2c(c1)cccc2[C@H]3C(=O)c4ccsc4O3
|
|
544
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
545
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
546
|
c1c[nH]nc1c2nccs2
|
|
547
|
c1cc2c(cc1C3CCCCC3)c4c([nH]2)C(=O)CC=C4
|
|
548
|
c1cnc(cn1)c2nnc(o2)N
|
|
549
|
c1cc(cc(c1)Cl)n2ccc(n2)c3cnccn3
|
|
550
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
551
|
CCc1n[n-]/c(=N/C(=O)c2c(c(c(c(c2F)F)F)F)F)/s1
|
|
552
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
553
|
CCOC(=O)C1=C(Oc2ccccc2NC1=O)N
|
|
554
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
555
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
556
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
557
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
558
|
Cc1csc(n1)c2cn[nH]c2N
|
|
559
|
Cc1coc(=O)n1c2ccc(c(c2)Cl)Cl
|
|
560
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
561
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
562
|
c1cc(c(cc1F)c2c(nc3n(c2=O)CCCC3)[O-])F
|
|
563
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
564
|
Cc1cccc(c1)NC(=O)n2cccn2
|
|
565
|
Cc1c(c(on1)N)C2=CCCCC2
|
|
566
|
CC(C)Nc1n[nH]c(=O)n1C(C)C
|
|
567
|
c1ccc2c(c1)c(ns2)NCc3cccs3
|
|
568
|
Cc1cc([nH]c(=O)c1C2=NCCNC(=C2)C(F)(F)F)C
|
|
569
|
c1ccc(cc1)c2cc(on2)[C@@]3(CC[C@H]4CO[C@@H]3O4)O
|
|
570
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
571
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
572
|
Cn1ccc(=NC(=O)c2ccccc2)cc1
|
|
573
|
[H]/N=c/n(cc(s1)c2ccccc2)c3ccccc3C
|
|
574
|
Cc1coc2n1cc(n2)c3ccc(cc3)Cl
|
|
575
|
c1cc(ccc1[C@@H](c2c(nc3nnc(n3n2)N)[O-])C(=O)[O-])Cl
|
|
576
|
c1ccc(cc1)n2ncc(n2)c3[n-]nnn3
|
|
577
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
578
|
Cc1nc(c(o1)Sc2ccc(cc2)Cl)C#N
|
|
579
|
Cc1c(nnn1c2ccsc2C(=O)OC)C(=O)C
|
|
580
|
CCNc1nc(nc(n1)Cl)Sc2nnc(s2)SC
|
|
581
|
CC=C(C(=O)N/C1=C/c2ccccn2)C
|
|
582
|
Cc1cc(=O)c(c(o1)Nc2ccccc2)C(=O)C
|
|
583
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
584
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
585
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
586
|
C[C@@]1(C[C@@H](NC2N1NCN2)C3CCCCC3O)O
|
|
587
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
588
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
589
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
590
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
591
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
592
|
Cc1cc(=O)oc2c1c(=O)[nH]nc2c3ccccc3
|
|
593
|
CCc1ccc(cc1)N2C(=O)CC(=O)N=C2O
|
|
594
|
Cc1c(cnc(c1C#N)N)Cc2cc(ccc2OC)OC
|
|
595
|
CC(=O)Nc1cc2c(oc1=O)CCC2=O
|
|
596
|
CC1=C[C@@]2(C(=C(O1)N)C(=O)N)Nc3ccccc3O2
|
|
597
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
598
|
c1ccc2c(c1)[C@@]3(C(=O)N2)N=C(NC(=N3)N4CCOCC4)N
|
|
599
|
Cc1c(cco1)c2nc3n(n2)C[C@@H]4[C@@H]3C=CC=C4
|
|
600
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
601
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
602
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
|
603
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
604
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
605
|
Cc1c(c(on1)N)C2=CCN(CC2)C(=O)C
|
|
606
|
Cc1nc2cc(ccc2s1)/[NH+]=c/ccc4ccccc4n3C
|
|
607
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
608
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
609
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
610
|
CC(C)c1nc(cs1)CNC(=O)c2c(ocn2)C3CC3
|
|
611
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
612
|
CC1=C(CCC(=O)N1c2ccccc2)n3c4ccccc4nn3
|
|
613
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
614
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
615
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
616
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
617
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
618
|
c1cc(cc(c1)OCc2cscn2)N
|
|
619
|
COC1=C(C(=O)N[C@@H]1C(=O)c2ccccc2)C(=O)OC
|
|
620
|
COC(=O)[C@]12C(=NC=N1)C=NC=N2
|
|
621
|
CN(CCn1cccn1)c2ccccc2
|
|
622
|
CCn1c2ccncc2nc1C3=CCNC=C3
|
|
623
|
Cc1cc(c(c(=O)n1C)Sc2ccccc2)[O-]
|
|
624
|
CC1=Nc2c(c(nc(n2)N3CCCCC3)N)C1=O
|
|
625
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
626
|
c1ccc(cc1)C(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
627
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
628
|
COC(=O)CCc1c[nH]cn1
|
|
629
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
630
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
631
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
632
|
CSC1NC2C(S1)NC(OC2=O)C3CCCCC3
|
|
633
|
Cc1c2c(cc([o+]1)c3ccccc3)CCC2
|
|
634
|
c1ccc2c(c1)nnn2c3nnns3
|
|
635
|
CCc1nc2ccsc2c(n1)c3ccccn3
|
|
636
|
Cn1cc(c(c1[C@@H]2CCCO2)C(=O)[O-])c3ccccc3
|
|
637
|
COC(=O)Nc1cn2ccccc2n1
|
|
638
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
639
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
640
|
c1ccc(cc1)c2nnc3n2CCCS3
|
|
641
|
Cc1cc(c(nn1)N)C(=O)N
|
|
642
|
c1ccc2c(c1)CC=N[C@@H]2Cn3c4ccccc4nn3
|
|
643
|
|
|
644
|
C[C@@H]1C(=NC(=NC1=O)c2ccccc2)C(=O)[O-]
|
|
645
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
646
|
Cc1c(c(n(n1)c2ccccc2)[O-])/C=C/C=Nc4c3cccc4
|
|
647
|
|
|
648
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
649
|
c1ccc(cc1)Nn2c3ccccc3nn2
|
|
650
|
Cc1ccc(c(c1)C)C2=CSc3ccccc3N2
|
|
651
|
CNc2cc[nH+]cc2N/C1=C/3C=Nc4c3cccc4
|
|
652
|
c1ccc(cc1)/C=C/Cn2c(=O)c3c(cccn3)oc2=O
|
|
653
|
Cc1c(oc(n1)S[C@@H](C)c2cccnc2)C
|
|
654
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
655
|
Cc1cs/c(=NC)/n1NC(=O)Nc2ccc(cc2)Cl
|
|
656
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
657
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
658
|
CC1CCC2C(C1)NC(C(=O)O2)C3CCCCC3
|
|
659
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
660
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
661
|
Cc1c(c(nc(c1Cl)C)S(=O)(=O)NC2CC2)C#N
|
|
662
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
663
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
664
|
Cc1cnc(nc1c2ncnn2C)N
|
|
665
|
c1ccc(cc1)S(=O)(=O)C[C@@H]2CSc3n2ncn3
|
|
666
|
c1ccc(cc1)c2ccc(n2Cc3cccc(n3)N)c4ccccc4
|
|
667
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
668
|
c1ccc(cc1)n2cc(cn2)CSc3nncs3
|
|
669
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
670
|
C[C@@H]1Nc2ccccc2-c3c(nc(nn3)SC)O1
|
|
671
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
672
|
c1ccc2c(c1)c(nnn2)Nc3ccccc3Cl
|
|
673
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
674
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
675
|
CC1=C(Oc2ccccc2N1)C(=O)Nc3ccccc3
|
|
676
|
c1cnccc1c2nnc3n2CCC3
|
|
677
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
678
|
Cc1c(c2c(o1)[C@@H]3CCCC[C@@H]3OC2=O)c4ccccc4
|
|
679
|
Cc1cc(c(n1C)C)C(=O)COn2c3cc(ccc3nn2)Cl
|
|
680
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
681
|
Cc1cc(=O)n2ccccc2n1
|
|
682
|
Cc1c(c2ccccc2n1C)c3cc(n[nH]c3=O)c4ccccc4
|
|
683
|
c1ccnc(c1)CCSc2nncs2
|
|
684
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
685
|
CS(=O)(=O)N1CCCN(CC1)Cc2nnnn2C3CC3
|
|
686
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
687
|
CC(C)(C)OC(=O)N1CCCCc2c1nccc2
|
|
688
|
c1ccc(cc1)[C@@H]2C(=O)Oc3cccnc3S2
|
|
689
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
690
|
Cn1c(=O)c(nn(c1=O)C)Oc2ccc3c(c2)OCO3
|
|
691
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
692
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
693
|
C1CCC2C(C1)C[C@@H]3[C@@H]2C4CCCCC4N3
|
|
694
|
Cc1c2ccccc2c(nn1)Sc3nccn3C
|
|
695
|
Cc1cc(nc(c1C(=O)N)c2cnn(c2)C)C
|
|
696
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
697
|
c1csc(n1)/N=C(/CN2CCOCC2)[O-]
|
|
698
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
699
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
700
|
COc1nc(nc(n1)OC)C(=O)c2ccccc2
|
|
701
|
Cc1cc(=O)n2c3ccccc3nc2o1
|
|
702
|
Cn1c(cc(=O)n(c1=O)C)Cn2ccccc2=O
|
|
703
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
704
|
Cn1c(=O)n(oc1=O)c2ccccc2
|
|
705
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
706
|
CCC/N=c/c(=N/c2cccnc2)/c(c1O)O
|
|
707
|
C[C@@H](c1cccs1)NC2=NC(=O)CN2C
|
|
708
|
CN1c2ccccc2S[C@@]13COc4ccccc4O3
|
|
709
|
c1ccc2c(c1)c(=O)c-3nc(=O)nc23
|
|
710
|
CN(c1ccc(cc1)OC)c2c3c(ccn2)ccs3
|
|
711
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
712
|
Cc1c(nccn1)c2ccnn2S(=O)(=O)c3ccccc3
|
|
713
|
c1ccc2c(c1)Nc3c(cccn3)S2
|
|
714
|
Cc1c(c(c2ncnn2n1)[O-])Cl
|
|
715
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
716
|
Cc1nnc(o1)CSc2nccn2C
|
|
717
|
c1ccc2c(c1)Nc3cc(ccc3S2)c4cc[nH]n4
|
|
718
|
c1cc(oc1)c2nnc(s2)N
|
|
719
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
720
|
c1ccc-2c(c1)Cc3c2ccc(c3)n4cccc4
|
|
721
|
Cc1c(c(on1)C)Cn2ccccc2=O
|
|
722
|
Cc1cn2c(n1)-c3ccccc3C2
|
|
723
|
C1C[C@@H](Cc2c1snn2)C(=O)[O-]
|
|
724
|
Cc1csc(=O)n1CCC(=O)[C@@H](C#N)c2ccccn2
|
|
725
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
726
|
c1ccc(cc1)CC2=C(C=NC(=O)C2)C(=O)N
|
|
727
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
728
|
c1cc2c(cc1Cl)N3CCS(=O)(=O)N=C3O2
|
|
729
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
730
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
731
|
c1ccc2c(c1)N=C(C[C@@H](S2)c3cccs3)c4ccco4
|
|
732
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
733
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
734
|
C1CSCC1C2[NH]NC(N2)C3CCSC3
|
|
735
|
c1ccc(cc1)CCN2CC3=C(CCCC3=O)NC2
|
|
736
|
COC(=O)/C=C/C(=O)N2c3ccccc3[N-]C2=N1
|
|
737
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
738
|
Cc1cc(nc(n1)SN2CCCCC2)C
|
|
739
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
740
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
741
|
c1ccc(cc1)[C@@H]2CCCC=CO2
|
|
742
|
CCCn1c(n[nH]c1=O)c2cccs2
|
|
743
|
c1cc(ccc1C#N)OC(=O)Cc2ccsc2
|
|
744
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
745
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
746
|
c1ccc(cc1)S(=O)(=O)NCc2nccs2
|
|
747
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
748
|
CCn1c(=O)n-2c(n1)COc3c2cc(cc3)Cl
|
|
749
|
|
|
750
|
C1CCC2CC3C(CC2C1)[C@@]4(C5CCCCC5C(=O)[C@@]4(O3)O)O
|
|
751
|
Cc1cccc(c1NC(=O)/N=C/CCCN2C)C
|
|
752
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
753
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
754
|
Cc1cccn2c1nc(c2c3nnc(n3C)SCC=C)C
|
|
755
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
756
|
c1cc(oc1)/C=C/c2nn3cnnc3s2
|
|
757
|
c1ccc2c(c1)CC(=C2)N3CCCCC3
|
|
758
|
c1ccc2c(c1)[C@@H](OC2=O)NS(=O)(=O)c3ccc(cc3)Cl
|
|
759
|
CC(C)C(=O)N1CCc2c(cnn2C)C1
|
|
760
|
c1ccc(cc1)c2ccccn2
|
|
761
|
CCOC(=O)c1c(c2c([nH]1)cccc2F)N
|
|
762
|
Cc1c(nn(c(=O)c1C#N)Cc2nc3ccccc3o2)C
|
|
763
|
CC1(O[C@@H]2[C@@H]3C=C[C@H]([C@@H]2O1)C(=C3C(=O)[O-])C(=O)OC)C
|
|
764
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
765
|
c1ccc(cc1)c2cn(c(=O)o2)c3ccccc3
|
|
766
|
c1ccc(cc1)[C@@]2(c3cnncc3C(=O)N2)O
|
|
767
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
768
|
C[C@@H]1Cc2nc(cc(=O)n2N1c3ccccc3)[O-]
|
|
769
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
770
|
CN(Cc1nnc(s1)SC)c2ccccc2F
|
|
771
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
772
|
c1ccc(cc1)CS(=O)(=O)n2ccnc2
|
|
773
|
Cc1nc2ccccc2c3n1nc(n3)n4cnnn4
|
|
774
|
Cc1nnc(o1)C(=O)c2c(c3ccccc3n(c2=O)C)OC(=O)C
|
|
775
|
c1cc(oc1)OC(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
776
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
777
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
778
|
c1cc(ccc1N2C3=CCCCC3=C(C2=O)O)Cl
|
|
779
|
c1ccc(cc1)n2nc3ccc4c(c3n2)non4
|
|
780
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
781
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
782
|
c1ccc(cc1)c2cn(c(cc2=O)C(F)(F)F)CC(=O)[O-]
|
|
783
|
Cc1c2c(ccc(n2)NC(=O)C)n(n1)C
|
|
784
|
Cc1c(c(n(n1)c2ccccc2)Cn3c4ccccc4oc3=O)C#N
|
|
785
|
Cc1c(c2nnnn2c(n1)c3ccccn3)Cl
|
|
786
|
COc1ccc(cc1)[C@H]2C(=C(C2=O)c3ccc(cc3)OC)[O-]
|
|
787
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
788
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
789
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
790
|
|
|
791
|
C[C@H]1[C@@H]([C@H](C=CO1)O)OCc2ccccc2
|
|
792
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
793
|
CC1(CC2=C(c3c1c[nH]n3)Sc4ccccc4N2)C
|
|
794
|
CC1(OC2=C([C@@H]3c4ccccc4OC[C@@H]3CO2)C(=O)O1)C
|
|
795
|
Cc1c(c(sn1)C)Nc2c(c(ncn2)SC)C#N
|
|
796
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
797
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
798
|
CC1([C@@](c2ccccc2O1)(c3ccc4ccccc4n3)O)C
|
|
799
|
CC1(NC(=O)[C@@H](O1)/C=C/C2CCCCC2)C
|
|
800
|
CN1C2C(C(=O)N(C1=O)C)N[C@@]3(N2)C4CCCCC4NC3=O
|
|
801
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
802
|
Cc1c(c(on1)C)Nc2c(c(ncn2)SC)C#N
|
|
803
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
804
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
805
|
CN1CC[C@@H](c2c1cccc2)n3c4ccccc4nn3
|
|
806
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
807
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
808
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
809
|
CC1=CC(=O)N([C@@]1(CC#N)O)C2CC(CCC2OC)OC
|
|
810
|
c1ccc(cc1)Cn2c(c(nn2)c3[nH]c4ccccc4n3)N
|
|
811
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
812
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
813
|
|
|
814
|
C1CCC2C(C1)CC[C@@H]2CC3CCCCN3
|
|
815
|
c1ccc(cc1)c2c(=O)c3cscc3[nH]c2[O-]
|
|
816
|
Cn1c(cnc1c2cc(=O)c3ccccc3o2)Cl
|
|
817
|
c1ccc(cc1)n2cc(cn2)c3c4cc(ccc4on3)F
|
|
818
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
819
|
C1CCC2C(C1)[C@@H](N3C4CCCCC4C(=O)C3=N2)O
|
|
820
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
821
|
CC(=O)Nc1ccc(o1)C(=O)[O-]
|
|
822
|
|
|
823
|
c1ccc(cc1)C#CC(=O)c2cccs2
|
|
824
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
825
|
c1ccc(cc1)C(=O)NC2=NC(=O)[C@@H]3C(=N2)[N-]C=N3
|
|
826
|
Cc1c(oc(n1)NS(=O)(=O)c2ccc(cc2)N)C
|
|
827
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
828
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
829
|
CCOc1nnc(s1)Cn2c(=O)c(c(c(n2)C)C)C#N
|
|
830
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
831
|
Cc1cc(=O)cc(o1)/C=C/c2ccnn2C
|
|
832
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
833
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
834
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
835
|
c1ccc(cc1)NC2=CC(=O)OC2
|
|
836
|
Cc1nc(nc(=O)n1c2ccccc2)Nc3ccccc3
|
|
837
|
|
|
838
|
c1cnc(nc1)N2CCc3c(ccs3)C2
|
|
839
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
840
|
c1cc(oc1)c2csc(n2)CC#N
|
|
841
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
842
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
843
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
844
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
845
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
846
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
847
|
c1ccc(cc1)c2nnnn2C3(CCCCC3)n4cccn4
|
|
848
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
849
|
COc1ccc(cc1)/N=c/c3ccccc3[nH]c(=O)cn2
|
|
850
|
Cc1nccn1C(=O)[C@@H]2[C@@H]3C[C@H]([C@@H]2C(=O)[O-])C=C3
|
|
851
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
852
|
[H]/N=c/n(c2c(s1)nc3ccccc3n2)N
|
|
853
|
COc1ccc(cc1)C2=NCSc3n2ncn3
|
|
854
|
c1ccc2c(c1)/C(=N/c3ccccn3)/C(=O)N2
|
|
855
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
856
|
Cn1cc(ccc1=O)c2c(cccn2)Cl
|
|
857
|
Cc1c(c2c3nnc(n3cnc2o1)C)C(=O)[O-]
|
|
858
|
Cc1c(non1)NCNc2c(non2)C
|
|
859
|
|
|
860
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
861
|
|
|
862
|
COC(=O)c1c2c(nnc(n2nc1C(=O)OC)[O-])c3ccccc3
|
|
863
|
COC(=O)c1c([nH]c(c1C(=O)OC)c2ccsc2)C#N
|
|
864
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
865
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)no2
|
|
866
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
867
|
CC1NC2C(S1)NC(NN2)C3CCCCC3
|
|
868
|
Cc1cc(c(nn1)[O-])c2nc3ccccc3n2C
|
|
869
|
c1ccc(cc1)C[C@@H](C(=O)[C@@H](C#N)c2ccccn2)n3cnnn3
|
|
870
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
871
|
Cc1c(=O)nc2n(n1)cnc3n2nc(c3)c4ccccc4
|
|
872
|
COc1ccc2c(n1)cc([nH]2)C=C
|
|
873
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
874
|
c1ccc(cc1)[C@@H]2CNC3=C2C(=O)Nc4ccccc4N3
|
|
875
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
876
|
COc1cc(ccc1[C@@H]2N[C@@H]3C=CC=NC3=N2)[S@@](=O)C
|
|
877
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
878
|
c1ccc2c(c1)[C@@H]3C4=C(CCCC4)C(=C3NC2=O)C(=O)N
|
|
879
|
c1cc(=O)n(cc1C(F)(F)F)Cc2nnnn2C3CC3
|
|
880
|
|
|
881
|
Cc1nc(c(c(n1)SC)C#N)n2cccc2
|
|
882
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
883
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
884
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
885
|
CN(C)C(=O)Nc1[n-]nnn1
|
|
886
|
|
|
887
|
Cc1ccc(cc1)/N=c/2c3c[nH]nc3[nH]cn2
|
|
888
|
c1cc(oc1)c2ccnc(n2)N
|
|
889
|
CCOC(=O)C1=NC2=CCn3ccnc3C2=C1
|
|
890
|
c1cc(c2c(c1)SCc3ccsc3C2=O)N
|
|
891
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
892
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
893
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
894
|
c1cc(ccc1[C@@H]2[C@]3([C@@]2(C(=O)N=C3[O-])C#N)C#N)F
|
|
895
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
896
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
897
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
898
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
899
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
900
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
901
|
Cc1c(=O)n2c(nn1)sc(n2)c3ccco3
|
|
902
|
c1ccc2c(c1)/C(=N/c3[nH]c4ccccc4n3)/NC2=O
|
|
903
|
Cc1cc(nc2c1c(on2)N)C
|
|
904
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
905
|
Cc1ccc(cc1)n2cnc(=O)c(n2)C#N
|
|
906
|
c1csc(n1)c2nccs2
|
|
907
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
908
|
c1ccc2c(c1)[C@@H]3N4[C@@H]2OCC4(CO3)CO
|
|
909
|
CCNc1nc(nc(n1)Sc2ccc(cc2)C(=O)OC)N
|
|
910
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
911
|
Cn1c(cc(n1)Oc2ccc(cn2)C(F)(F)F)C(F)(F)F
|
|
912
|
CC(=O)C1C2C(NC(N1)C(=O)C)N(CN2)C(=O)C
|
|
913
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
914
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
915
|
CC(=O)OC1C2C(C(NN1)[O-])SCCS2
|
|
916
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
917
|
c1ccc2c(c1)CSc3ccccc3N2
|
|
918
|
CN1C=C[C@@H](C2C1CCCC2)[C@@H](C#N)C3CCCCC3
|
|
919
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
920
|
C1CCC(CC1)C2C3C(NO2)CCC3
|
|
921
|
CC[C@@]1(CN(CC=C1)C(=O)OC2CCCCC2)CC(=O)N(C)C
|
|
922
|
|
|
923
|
c1cc(n[nH]c1=O)NC2CC2
|
|
924
|
[H]/N=C/N/C(=Nc2ccccc2Cl)/NC(N1)(C)C
|
|
925
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
926
|
CC1=CC(NC(=O)N1c2ccccc2)(C)C
|
|
927
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
928
|
c1ccc(cc1)C2=CC=C(C2)c3ccccc3
|
|
929
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
930
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
931
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
932
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
933
|
Cc1cc(n(n1)c2c(c([nH]n2)C)N)C
|
|
934
|
c1cc(ccc1[C@@H]2CN=CC=N2)[C@@H]3CN=CC=N3
|
|
935
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
936
|
c1ccc2c(c1)c(co2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
937
|
COC(=O)Nc1c(ccs1)OCc2ccc(cc2)Cl
|
|
938
|
c1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)[O-]
|
|
939
|
c1ccc(cc1)C2=Nc3ccccc3N[C@H]2C(=O)[O-]
|
|
940
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
941
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
942
|
CCOC(=O)/N=c/1ccccn1[O-]
|
|
943
|
Cc1c(c(no1)c2ccccc2)c3ccn[nH]3
|
|
944
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
945
|
c1ccc2c(c1)C(=O)/C(=N
3cnnc3)/N2
|
|
946
|
CCSc1nnc(o1)c2c(nc3n2ccs3)C
|
|
947
|
CNc1nnc(s1)c2cnccn2
|
|
948
|
c1ccc(cc1)n2c3c(cn2)C(=O)CC3
|
|
949
|
c1cc(ccc1c2c3ccoc3ccn2)C(=O)N
|
|
950
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
951
|
c1ccc(cc1)N2CC(=O)Nc3ccccc3S2(=O)=O
|
|
952
|
Cc1ccc(c(c1)n2c3c(nn2)[C@@](CS3)(c4ccccc4)O)C
|
|
953
|
Cc1c(nnc(c1c2c(cc(cn2)C(F)(F)F)Cl)O)C
|
|
954
|
CC1=C[C@@H]2c3c(non3)C=CC2=N1
|
|
955
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
956
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
957
|
Cc1ccc2c(c1)[C@@]3(C(=O)c4ccccc4[C@@]3(O2)O)O
|
|
958
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
959
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
960
|
c1ccc(cc1)Nc2ccccn2
|
|
961
|
|
|
962
|
CC1C(CC(NN1)C2CCCCC2)N(C)C3CCCCC3
|
|
963
|
c1ccc(cc1)n2nc3c(n2)-c4c(non4)CC3
|
|
964
|
CC(=O)N1CCC=C1Cc2ccccc2
|
|
965
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
966
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
967
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
968
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
969
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
970
|
|
|
971
|
C1[C@@H]2N(C1=O)[C@@H](/C(=C/CO)/O2)C(=O)[O-]
|
|
972
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
973
|
c1ccc(cc1)S[C@@H]2[C@@H]3C=CC[C@@H]3C2=O
|
|
974
|
Cc1cc(c(c(=O)o1)SC([C@@H](C(F)(F)F)F)(F)F)[O-]
|
|
975
|
CSc1nc(c(n1Cc2ccco2)C#N)N
|
|
976
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
977
|
CC[C@H](C)[C@@H]1C(=Nc2ccccc2C(=N1)O)O
|
|
978
|
|
|
979
|
CCOC1=CC(=O)N(C1)c2ccc(cc2)C
|
|
980
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
981
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
982
|
CC1=C2C=CC=C[C@@H]2c3nc4ccc(cc4n3N1)Cl
|
|
983
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
984
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
985
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
986
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
987
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
988
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
989
|
CCOC(=O)c1c2n(c3c1ncnc3SC)CCC2
|
|
990
|
c1ccc(cc1)n2c3c(cn2)CNCC3
|
|
991
|
Cc1csc(=O)n1CN(C)Cc2ccc(s2)Cl
|
|
992
|
c1cc(oc1)c2nnc3n2CCCCC3
|
|
993
|
C1CCC(CC1)NC2C(C(=O)SS2)CL
|
|
994
|
COC(=O)c1cccc2n1ncn2
|
|
995
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
996
|
c1ccc(cc1)c2cc3ccsc3o2
|
|
997
|
Cn1cc(nc(c1=O)Nc2ccccc2)Br
|
|
998
|
CN1C(=O)C(=C(C12CCC2)N)S(=O)(=O)c3ccc(cc3)Cl
|
|
999
|
COC1CCC2C(C1)O[C@@]3(C4CC5C(CC4O[C@@H]3C2)OCO5)O
|
|
1000
|
Cc1ccc(c(n1)N)Cn2c(c(sc2=O)CCO)C
|
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