(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
|
|
2
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
3
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
4
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
5
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
6
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
7
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
8
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
9
|
C1CCC(CC1)CC2CCC[NH]2
|
|
10
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
11
|
c1ccc(c(c1)N)Sc2cc(nnc2Cl)Cl
|
|
12
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
13
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
14
|
|
|
15
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
16
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
17
|
|
|
18
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
19
|
c1cn[nH]c1c2ccsc2
|
|
20
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
21
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
22
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
23
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
24
|
CC1=C[C@@H](CC(=O)N1)c2ccco2
|
|
25
|
C[C@@]1(COC(=N1)COc2ccccc2)CO
|
|
26
|
c1ccc(cc1)NC(=O)n2ccnc2
|
|
27
|
CCCCCCC1CN[NH]N1
|
|
28
|
c1c(=O)[nH]c(nc1[O-])Nn2cnnc2
|
|
29
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
30
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
31
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
32
|
c1cc(sc1)c2ccn[nH]2
|
|
33
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
34
|
C[C@@H](N1CCNC1)OCCCC2CCCCC2
|
|
35
|
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C=C1)O
|
|
36
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
37
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
38
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
39
|
c1ccc(cc1)c2cn(nn2)CC(=O)[O-]
|
|
40
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
41
|
c1cc(ccc1SCCCn2ccnc2)Cl
|
|
42
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
43
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
44
|
c1ccc(cc1)NCn2cncn2
|
|
45
|
c1ccnc(c1)c2cn(cn2)c3cccc(c3)C#N
|
|
46
|
COC(=O)N[C@@H]1CC=CC[C@@H]1F
|
|
47
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
48
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
49
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
50
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
51
|
c1cc(ccc1C2=C(N=CC2)c3ccncc3)F
|
|
52
|
Cc1c(cn(n1)CC=C)CNCc2c(nns2)C
|
|
53
|
c1cnccc1CSc2nncs2
|
|
54
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
55
|
COc1ccc-2c(c1)CCc3c2onc3
|
|
56
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
57
|
c1cscc1OC(=O)C2=NC(=O)CC=C2
|
|
58
|
c1ccc(cc1)NC2=CC(=O)OC2
|
|
59
|
c1cc(sc1)c2cc(c(nn2)O)NC(=O)C3CCC3
|
|
60
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
61
|
c1nncn1/N=N/n2cnnc2
|
|
62
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
63
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
64
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
65
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
66
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
67
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
68
|
c1ccc(cc1)C[C@@H]2CCOC(=O)N2
|
|
69
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
70
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
71
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
72
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
73
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
74
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
75
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
76
|
Cn1cc(cn1)NCc2ccco2
|
|
77
|
Cn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
78
|
C1CCC(CC1)NSC2CCCCC2
|
|
79
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
80
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
81
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
82
|
C1CCC(CC1)S(=O)(=O)NCCN2CCNC2
|
|
83
|
Cn1nc(nn1)c2ccc(c(c2)N)O
|
|
84
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
85
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
86
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
87
|
C1CCC(CC1)[C@@H]2CC(=O)OC2
|
|
88
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
89
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
90
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
91
|
CC(=O)NCCn1cccc1
|
|
92
|
C1CC([NH]C1)C(=O)OCC#N
|
|
93
|
c1ccc2c(c1)CC[NH+]=C(N2)N3CCOCC3
|
|
94
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
95
|
Cc1nnc(o1)CSc2ccccn2
|
|
96
|
Cc1c(c(on1)C)Cc2ccc(s2)C(=O)[O-]
|
|
97
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
98
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
99
|
CC1=C[C@@H](n2c(ncn2)N1)c3ccccc3F
|
|
100
|
C1C(C(NCN1)N)CCC2OCCO2
|
|
101
|
c1ccc(cc1)CCc2csnn2
|
|
102
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
103
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
104
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
105
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
106
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
107
|
c1ccc(cc1)C(=C2C=CC=C2)O
|
|
108
|
c1cc(oc1)CNn2cnnc2
|
|
109
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
110
|
c1cc(cc(c1)C(F)(F)F)c2ccc(o2)c3csnn3
|
|
111
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
112
|
c1ccc2c(c1)c3ccc(cc3o2)n4ncnn4
|
|
113
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
114
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
115
|
c1ccc(cc1)CCn2cnnn2
|
|
116
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
117
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
118
|
Cc1ccc2c(c1)Nc3c(c(=O)c3=O)N2
|
|
119
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
120
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
121
|
CN1C(=C/C(=C/2N=NC(=[NH2+])O2)/NC1=O)[O-]
|
|
122
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
123
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
124
|
c1ccc(cc1)NCc2cscn2
|
|
125
|
c1cc(cc(c1)F)[N-]S(=O)(=O)c2cc(oc2)C(=O)N
|
|
126
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
127
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
128
|
Cc1c(c[nH]n1)c2ccccc2
|
|
129
|
c1ccc(cc1)CCOn2ccnc2
|
|
130
|
CCCCCNC1=[NH+]C(=N/C(=C/C=C(C=CC2=O)Cl)/N1)N
|
|
131
|
c1ccc(c(c1)C(=O)C2=C[C@H](C(=O)N=C2)C#N)O
|
|
132
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
133
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
134
|
COC1=C(COC1=O)CC2CCCCC2
|
|
135
|
c1cc(oc1)CNc2nccs2
|
|
136
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
137
|
CC[C@@H](c1cnn(c1)C)NC(=O)c2c(ocn2)C
|
|
138
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
139
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
140
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
141
|
C/C(=C/Oc1ccccc1)/C=C/OC
|
|
142
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
143
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
144
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
145
|
|
|
146
|
c1ccc(cc1)OCCn2ccnc2
|
|
147
|
c1c2c(sc1Cn3cc(c(nc3=O)[O-])C#N)CCCC2
|
|
148
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
149
|
CC1=NC(=O)CN1c2ccccc2
|
|
150
|
c1ccc(cc1)C(=O)CC2=CCCCC2
|
|
151
|
c1cc(c(cc1c2cn(nn2)C3CCCCC3)Cl)Cl
|
|
152
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
153
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
154
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
155
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
156
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
157
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
158
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
159
|
c1cc2c(cc1C3CCCCC3)c4c([nH]2)C(=O)CC=C4
|
|
160
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
161
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
162
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
163
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
164
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
165
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
166
|
|
|
167
|
c1ccc2c(c1)CCc3ccccc3N2
|
|
168
|
CC1=NCC[C@@H]1c2ccccc2
|
|
169
|
COC(=O)N1C[C@H]2COC(=O)[C@H]2C1
|
|
170
|
|
|
171
|
Cc1c(c(on1)N)C2=CCN(CC2)C(=O)C
|
|
172
|
c1cc(cnc1)C(=O)c2ccco2
|
|
173
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
174
|
c1cc(sc1)C(=O)n2cnnc2N
|
|
175
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
176
|
c1ccc2cc3c(cc2c1)NC=C4C(=NC(=O)S4)[N-]3
|
|
177
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
178
|
CC1(CO/C(=C/C(=O)c2ccccc2)/N1)C
|
|
179
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
180
|
c1c(c([nH]n1)N)C2=CCCCC2
|
|
181
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
182
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
183
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
184
|
c1ccc(cc1)c2ncc(s2)c3ccno3
|
|
185
|
C1CCC(C(C1)NC2[NH+]C(C(N2O)[O-])N)F
|
|
186
|
|
|
187
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
188
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
189
|
CC1CC(N(N1)C2CC(NNC2)[O-])C
|
|
190
|
C1CSCC1C2[NH]NC(N2)C3CCSC3
|
|
191
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
192
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
193
|
CC(=O)C(=C1Nc2ccccc2N1)C#N
|
|
194
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
195
|
CCOC1CCCC2N1CNN2
|
|
196
|
c1ccc(cc1)/C=C/2NC(=O)C(=O)O2
|
|
197
|
Cc1csc(n1)c2cn[nH]c2N
|
|
198
|
C1CNCC2C1NC(C(C2)C3=CCCCC3)N
|
|
199
|
CC(=O)N1CCC(=CC1)c2ccc(cc2)O
|
|
200
|
Cc1c2c([nH]n1)C(=O)N([C@@H]2c3ccco3)C
|
|
201
|
[H]/N=c/n(cc(s1)c2ccccc2)c3ccccc3C
|
|
202
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
203
|
COC(=O)Oc1c(c2c(s1)nc3ccccc3n2)N
|
|
204
|
CCOC(=O)[C@]1(N/C(=N/C)/O1)C(F)(F)F
|
|
205
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
206
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
207
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
208
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
209
|
COC(=O)c1c(=O)n([nH]n1)Cc2cccs2
|
|
210
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
211
|
c1cn(cn1)C(=O)n2ccnc2
|
|
212
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
213
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
214
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
215
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
216
|
c1ccc(cc1)C(=O)c2ccc(=O)oc2
|
|
217
|
C1CC1NC(=O)C2(CC2)C#N
|
|
218
|
c1cc(cnc1)C2=NC(=O)C3(N2)CCCC3
|
|
219
|
CCNC(=O)Cn1ccnc1
|
|
220
|
c1ccc2c(c1)ccc3c2c4c(o3)cno4
|
|
221
|
Cc1c(c2n(n1)[C@@H](C(=O)N2)CC(=O)[O-])c3ccccc3
|
|
222
|
c1ccc2c(c1)NC3(O2)CCCC3
|
|
223
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
224
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
225
|
Cc1ccccc1NC2=NC(=[NH+]C(N2)(C)C)N
|
|
226
|
c1ccc(cc1)C2=CC=C(C2)c3ccccc3
|
|
227
|
Cc1c(sc2n1cc(c2)c3ccccc3)C
|
|
228
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
229
|
c1ccc(c(c1)C(=O)[O-])S[C@@H]2CCC(=O)N2
|
|
230
|
Cc1cc(n(n1)CCc2nc(on2)c3ccccc3)C
|
|
231
|
c1ccc(cc1)Nn2cncn2
|
|
232
|
c1c2n(cn1)[C@@H](CCC2)CCCC#N
|
|
233
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
234
|
Cc1cc(no1)CSc2ccccn2
|
|
235
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
236
|
c1ccc(cc1)c2cncnc2
|
|
237
|
c1ccc(cc1)NC2=NN/C(=Nc3ccccc3)/[C@H]2Cl
|
|
238
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
239
|
c1cc(sc1)c2[nH]ccn2
|
|
240
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
241
|
c1ccc(cc1)[C@@H]2COC(=O)CN2
|
|
242
|
c1ccc(cc1)Cn2ccnc2
|
|
243
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
244
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
245
|
c1ccc(cc1)CC2=CC(=O)[C@H](C=N2)[O-]
|
|
246
|
C1CCC(CC1)C(=O)/C(=C/2NN=C3N2CCCCC3)/C#N
|
|
247
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
248
|
c1cc2c(nc1)NC3(N2)CCCCC3
|
|
249
|
C1CC(OC1)CNC2=NCCO2
|
|
250
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
251
|
c1ccc(cc1)NCCn2cccc2
|
|
252
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
253
|
C1CC/C(=C/2C=CC=[NH+]2)/NCC1
|
|
254
|
|
|
255
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
256
|
Cc1ccc(o1)SCc2ccco2
|
|
257
|
|
|
258
|
c1cc(sc1)CSc2ccc(cc2)O
|
|
259
|
CCCCc1ccc(cc1)On2ccc(=O)cc2
|
|
260
|
Cnccs/c1=NC(=O)c2ccc[nH]2
|
|
261
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
262
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
263
|
c1cc(oc1)Cn2c(ccn2)N
|
|
264
|
c1ccc(cc1)[C@H]2C(=O)NN=C2[O-]
|
|
265
|
CC1=C(CC2=C(N1)CC(CC2=C)(C)C)C(=O)OC
|
|
266
|
CC(=O)OC/C=C/c1cccnc1
|
|
267
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
268
|
CC1CCC(CC1)N2C=C(CC2=O)C3CCCCC3
|
|
269
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
270
|
c1ccc(cc1)C(=O)NCn2cncn2
|
|
271
|
c1cnsc1C(=O)N2CC(C2)F
|
|
272
|
C1CCC(CC1)SC2[N-]NNN2
|
|
273
|
CCOC(=O)c1nc2c(s1)NCCCC2
|
|
274
|
C[C@@H]([C@H]1[C@@H](NC1=O)OC(=O)C)O
|
|
275
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
276
|
|
|
277
|
c1cc2c(cc1Cl)-c3c(c[nH]n3)CS2
|
|
278
|
CC1C(C(OC(=O)[NH+]1)NC(C)C)CL
|
|
279
|
c1ccc(cc1)SCc2cnc(s2)Cl
|
|
280
|
Cc1nc2c(o1)CCc3ccccc3[C@@H]2O
|
|
281
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
282
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
283
|
CN1CNNC1CNS(=O)(=O)N2CCCCC2
|
|
284
|
c1cc(ccc1C(=O)[O-])/N=N/SCCO
|
|
285
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
286
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
287
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
288
|
Cc1cn(cn1)c2cccnc2
|
|
289
|
Cc1cc(cc(=O)o1)N2CCCCC2
|
|
290
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
291
|
c1ccc(cc1)COn2ccnc2
|
|
292
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
293
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
294
|
Cn1c(c(c(=O)n1c2ccccc2)C3=NCCC3)N
|
|
295
|
c1cc(oc(=O)c1)c2cccnc2
|
|
296
|
c1ccc(cc1)C[C@H]2C(=O)COC2=O
|
|
297
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
298
|
c1ccc(cc1)C2=NC(=O)CC(=O)N2
|
|
299
|
Cc1nnc(o1)SCC#C
|
|
300
|
CCOC(=O)C1=C(C(=O)N(C1)c2ccccc2)N
|
|
301
|
CC1(C=Cc2ccccc2N1)C
|
|
302
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
303
|
c1ccc(cc1)Sc2cccs2
|
|
304
|
CC(C)OC(=O)C1=NC(=O)CC=C1
|
|
305
|
C=CCOc1ccc(cc1)O
|
|
306
|
c1cc(cnc1)c2cccs2
|
|
307
|
C[C@H]1[C@@H]([C@H](C=CO1)O)OCc2ccccc2
|
|
308
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
309
|
C1CCC(CC1)SC[C@@]2(CCCC=C2)O
|
|
310
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
311
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
312
|
CCc1cc2c(s1)S[C@@H](NC2=O)c3ccccc3
|
|
313
|
c1cc(ccc1[C@@H](c2ccns2)O)F
|
|
314
|
c1ccn(c1)Cc2cccs2
|
|
315
|
c1c2c(c(s1)C#N)OCCO2
|
|
316
|
c1ccc2c(c1)NCCCS2
|
|
317
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
318
|
Cc1c(c(on1)N)Sc2ccc(cc2)Br
|
|
319
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
320
|
c1ccc(cc1)[C@@H]2COC(=O)N2
|
|
321
|
CC(=O)c1ccc(c(c1)F)Sc2nncs2
|
|
322
|
Cc1ccc(cc1)Nc2cc(cs2)[C@@]3(CCC(=O)O3)C
|
|
323
|
c1ccc(cc1)Sc2ccccc2
|
|
324
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
325
|
C1CCC(CC1)CC2=NCOC2=O
|
|
326
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
327
|
c1ccc(cc1)COc2c(nccn2)N
|
|
328
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
329
|
COc1ccccc1C/C=C/c2cccs2
|
|
330
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
331
|
C[C@@]12CCC(=O)N1CCN2C(=O)c3ccc(o3)COC
|
|
332
|
Cc1cc(sn1)NC(=O)c2ccco2
|
|
333
|
C1CCC2C(C1)[C@@H]3C[C@]2(C=C3)CO
|
|
334
|
c1cc(cnc1)CCNCc2cscn2
|
|
335
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
336
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
337
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
338
|
CN1C=CC(=CC2CCCCC2)C=C1
|
|
339
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
340
|
c1ccc(cc1)n2cc(cn2)Cn3cc(c(nc3=O)[O-])C#N
|
|
341
|
c1ccc2c(c1)C[C@@H]2c3ccccn3
|
|
342
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
343
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
344
|
Cc1c2cc(ccc2[nH]n1)F
|
|
345
|
CC(=O)c1cc2c(s1)SCC(=O)N2
|
|
346
|
c1ccc2c(c1)Nc3ccccc3O2
|
|
347
|
c1ccc(cc1)Sc2ccccn2
|
|
348
|
c1cc(sc1)C(=O)c2cnc3n2cccn3
|
|
349
|
Cc1[nH]nc(n1)c2ccccc2
|
|
350
|
c1ccc2c(c1)C(=O)CCCN2
|
|
351
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
352
|
CC(=O)c1csc(n1)c2ccno2
|
|
353
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
354
|
CCCCc1[nH]cc([nH+]1)CO
|
|
355
|
Cc1ncc(o1)Sc2cnc(s2)c3ccccc3
|
|
356
|
c1c(c(c(c(n1)F)F)F)F
|
|
357
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
358
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
359
|
C1CCC2C(C1)N[C@@H](S2)C3CCC[NH]3
|
|
360
|
c1cc(ccc1N)Oc2nccs2
|
|
361
|
C[S@@](=NC(=O)c1ccccc1)(=O)c2ccsc2
|
|
362
|
c1cc(cnc1)c2nc3c4c(ncn3n2)CCC4
|
|
363
|
c1ccc(cc1)CCc2cnccn2
|
|
364
|
C1CCC2(C1)NC3=C(CCC3)C(=O)N2
|
|
365
|
COC(=O)N1CCCNC(=O)C1
|
|
366
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
367
|
c1cc(cnc1)Cc2c3[nH]c4c(c(=O)n3[nH]c2=O)CCC4
|
|
368
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
369
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
370
|
|
|
371
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
372
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
373
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
374
|
|
|
375
|
CC1=C(CSN(C1)C2CCCCC2)C
|
|
376
|
CCOC(=O)N1CCNC(=O)C1
|
|
377
|
c1ccc(cc1)c2cc3cnsc3o2
|
|
378
|
CN(C)C(=O)N=c1[nH]c2ccccc2[nH]1
|
|
379
|
C[C@H]1OC[C@@H]([C@@H](O1)/C=C/C(=C/C(=O)OC)/C)O
|
|
380
|
c1ccnc(c1)SCc2ccco2
|
|
381
|
CC(=CCC/C(=C/CO)/C)C
|
|
382
|
Cc1nc(cs1)c2ccc[nH]2
|
|
383
|
C(CC#CC#CCCCO)CO
|
|
384
|
Cc1cc([nH]n1)OCCC#N
|
|
385
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
386
|
CN(c1ccccc1)c2ccc(s2)OC
|
|
387
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
388
|
CC(C)(C)NC(=O)c1ccc(cc1)Cl
|
|
389
|
c1ccc(cc1)CNc2c(non2)O
|
|
390
|
CC(=O)c1ccc-2c(c1)-c3c2cccc3
|
|
391
|
|
|
392
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
393
|
Cc1cc(n(n1)Cn2ccccc2=O)C
|
|
394
|
c1cc(ccc1[C@@H]2CN=CC=N2)[C@@H]3CN=CC=N3
|
|
395
|
C1CC[C@H](NCC1)N/C=C/C2=CCCCC2
|
|
396
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
397
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
398
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
399
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
400
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
401
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
402
|
CN1C(NCN1)CCC2CCCCC2
|
|
403
|
c1cc2c(cc1Cn3cnnc3)OCO2
|
|
404
|
Cn1c(cc(=O)n(c1=O)C)Cn2ccccc2=O
|
|
405
|
c1nncn1NC(=O)CC#N
|
|
406
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
407
|
c1ccc(cc1)COc2c(non2)N
|
|
408
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
409
|
c1ccc2c(c1)Cc3ccccc3NC2
|
|
410
|
c1cc(ccc1C2=C(CCC2)c3ccncc3)F
|
|
411
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
412
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
413
|
CC/C(=C/C1CSC2C1CCCC2)/C3CCNCC3
|
|
414
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
415
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
416
|
COC(=O)CCc1c[nH]cn1
|
|
417
|
CC1C(CNO1)/C=C/C2CCON2
|
|
418
|
Cc1c2c(on1)CCOC(=O)N2
|
|
419
|
C1CCC2C(C1)C[C@@H]3[C@@H]2C4CCCCC4N3
|
|
420
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
421
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
422
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
423
|
Cc1cc(ccc1F)C2=C[C@H]3C(=N2)CC(CC3=O)(C)C
|
|
424
|
c1ccc(cc1)Oc2ccsc2
|
|
425
|
c1ccc(cc1)CNn2cnnn2
|
|
426
|
Cn1cccc1/C=C(/c2ccccc2)OC
|
|
427
|
c1ccc2c(c1)c3cc(ccc3o2)S(=O)(=O)[O-]
|
|
428
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
429
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
430
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
431
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
432
|
CC(=O)c1ccc2nnnn2c1
|
|
433
|
Cc1nnc(o1)Nc2ccccc2
|
|
434
|
c1ccc(cc1)C(=O)C(O)O
|
|
435
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
436
|
c1cc(ccc1/N=C(/Nc2[n-]nnn2)O)Cl
|
|
437
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
438
|
CC1=CC(=O)N2CC3CC(CCC3N=C2N1)CL
|
|
439
|
c1ccc2c(c1)C(=O)OS(=O)(=O)N2
|
|
440
|
Cc1ccc(nc1C)c2ccoc2
|
|
441
|
Cc1c(non1)OCCOc2c(non2)C
|
|
442
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
443
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
444
|
c1cc(c2nncn2c1)Cl
|
|
445
|
c1cc2c(nc1)NCCC(=O)N2
|
|
446
|
CC1(Cc2c(sc(=O)nc2N)C1)C
|
|
447
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
448
|
c1ccc(cc1)Sc2ccn[nH]2
|
|
449
|
CN(C)C1=[NH+]C=CC(=CC1)c2ccccc2
|
|
450
|
c1ccc(cc1)c2c(cc(=O)[nH]n2)[O-]
|
|
451
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
452
|
c1ccc2c(c1)CC(=C2)N3CCCCC3
|
|
453
|
c1ccc(c(c1)C2=Nc3cncnc3NC2)N
|
|
454
|
CCOc1cc(c(o1)C)c2ccccc2
|
|
455
|
c1ccc2c(c1)C=Cc3ccccc3N2
|
|
456
|
CCS(=O)(=O)NCCn1cccn1
|
|
457
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
458
|
C1CCC(CC1)NC2CCC3N(C2=O)CCC3
|
|
459
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
460
|
c1ccc(cc1)COn2cc(cn2)I
|
|
461
|
c1ccc(cc1)Cn2cccn2
|
|
462
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
463
|
Cc1c(oc(n1)S[C@@H](C)c2cccnc2)C
|
|
464
|
c1nnc(s1)NCCC#N
|
|
465
|
|
|
466
|
c1ccc2c(c1)nn(n2)C3=CC(=O)N=[NH+]3
|
|
467
|
Cn1c(ccn1)CNC(=O)Cn2cccnc2=O
|
|
468
|
c1ccc(cc1)NC(=O)N[C@@H]2[C@@H](N=NS2)C(=O)[O-]
|
|
469
|
Cc1c(c(on1)N)C2=CCCCC2
|
|
470
|
c1ccc(cc1)C2=NC(=O)CN2
|
|
471
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
472
|
c1ccc(cc1)[C@@]2(C=C(C(=O)O2)O)O
|
|
473
|
c1ccc(cc1)c2cnccn2
|
|
474
|
c1cnc(nc1)SCc2cc(=O)c(co2)O
|
|
475
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
476
|
Cc1c(con1)c2ccccc2
|
|
477
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
478
|
Cn1cnnc1Cc2ccccc2
|
|
479
|
|
|
480
|
c1ccc2c(c1)N=CC=C(S2)c3cccnc3
|
|
481
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
482
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
483
|
CC1(C(=CC(=O)O1)SC2CCCCC2)C
|
|
484
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
485
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
486
|
CC(=CCC/C(=C/C=C)/C)C
|
|
487
|
CCSc1[nH]c(c(n1)C)CC(C)C
|
|
488
|
c1ccc(cc1)C#CC(=O)c2cccs2
|
|
489
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
490
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
491
|
|
|
492
|
c1ccc2c(c1)NC(N2)[C@@H]3CCC=CO3
|
|
493
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
494
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
495
|
c1ncn(n1)CCn2cncn2
|
|
496
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
497
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
498
|
CC(=O)OC1C2C3C2C4C3C41
|
|
499
|
c1ccc(cc1)C2=N/C(=C/Nc4ccccc4S3)/C(=O)N2
|
|
500
|
C1COC(N1)NC2CCCCC2
|
|
501
|
C1CCC(CC1)N2CCC=CC2
|
|
502
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
503
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
504
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
505
|
c1ccc(cc1)CNc2ncco2
|
|
506
|
c1ccc-2c(c1)-c3cccc4c3c2cnc4
|
|
507
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
508
|
CCOc1/c(=N/Cc2ccccc2)/c(=O)c1[O-]
|
|
509
|
|
|
510
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
511
|
c1ccc(cc1)NCc2ccco2
|
|
512
|
C1CCC(CC1)S[C@@H]2CCCO2
|
|
513
|
c1ccc-2c(c1)Cc3c2ccc(c3)n4cccc4
|
|
514
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
515
|
CCOC(=O)c1c([nH]n2c1nnc2C(F)F)C(F)(F)F
|
|
516
|
C(COCCOCCO)O
|
|
517
|
c1nc(c(n1CCO)N)C#N
|
|
518
|
c1ccc(cc1)C(=O)c2ccco2
|
|
519
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
520
|
c1ccc(c(c1)C(=O)O[C@@H]2Cn3c(nnn3)SC2)Cl
|
|
521
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
522
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
523
|
|
|
524
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
525
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
526
|
CC1([C@@H](C(=C(O1)N)C(=O)N)C2CCC(CC2)CL)C
|
|
527
|
c1ccc(cc1)OC2=CCCC=C2
|
|
528
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
529
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
530
|
|
|
531
|
C1CCC(CC1)C(=O)N[C@@H]2C(=O)NN=C2[O-]
|
|
532
|
COc1cc(n[nH]c1=O)Cl
|
|
533
|
C1CC=C(C1)[C@H]2CCCC2=O
|
|
534
|
C#CCCNc1c(=O)n(cc(n1)Cl)Cc2ccccc2
|
|
535
|
COC(=O)C1=NC(=CC(=O)C1)C(=O)OC
|
|
536
|
|
|
537
|
|
|
538
|
Cc1cc(no1)CSc2nncs2
|
|
539
|
C(C(F)(F)F)OSOCC(F)(F)F
|
|
540
|
c1ccc2c(c1)-n3cnnc3CCS2
|
|
541
|
COC(=O)C1=CNN2C1=NCN(C2)Cc3ccccc3
|
|
542
|
|
|
543
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
544
|
CCOC(=O)c1c(c([nH]n1)C)N
|
|
545
|
c1ccc(cc1)c2cn(nn2)c3ccccc3
|
|
546
|
CN1c2ccccc2C3(C1=O)[NH+]=c4ccccc4=[NH+]3
|
|
547
|
c1cc(ccc1C2=C/C(=C/3C=C(C=CC3=O)Cl)/ON2)F
|
|
548
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
549
|
c1ccc(cc1)[C@H]2[C@H](C(=O)N2)O
|
|
550
|
c1cc(c2c(c1)ncs2)N
|
|
551
|
c1ccc2c(c1)N[C@@H]3C[C@H](N2)O[C@@H]3[C@H](CO)O
|
|
552
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
553
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
554
|
C/C(=C/C(=O)[O-])/C(F)(F)F
|
|
555
|
C1CC(CCC1CC2CC(=O)C3C(S2)CCS3)F
|
|
556
|
c1ccc(cc1)NCc2cccs2
|
|
557
|
c1ccc(cc1)c2cc3c(nc2)CCc4c(cccc4C#N)C3
|
|
558
|
c1ccc(cc1)NC2=NCCCO2
|
|
559
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
560
|
CCCCC#C/C=C/COC(=O)C
|
|
561
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
562
|
CCn1cc(cn1)c2ccno2
|
|
563
|
CC(=O)NC1CCCN2C1NNN2
|
|
564
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
565
|
c1cocc1/C=C/2C(=NC(=O)N2)[O-]
|
|
566
|
|
|
567
|
Cc1cnn(c1)C(=O)c2c(noc2C)C
|
|
568
|
c1ccn(c1)c2c(non2)N
|
|
569
|
c1ccc(cc1)c2cc3n(c2)c4ccccc4n3N
|
|
570
|
c1cc(cc(c1)S(=O)(=O)N)C#Cc2ccc(=O)n(c2)[O-]
|
|
571
|
Cc1c2ccccc2nc(n1)NC3=N[C@@H](C=C(N3)COC)O
|
|
572
|
CCCC(=O)N[C@@]1(C(=O)N(C(=N1)O)C)C(F)(F)F
|
|
573
|
C[C@@]1(C(=O)N=C2N1C=CC=C2)CC(=O)[O-]
|
|
574
|
Cn1ccnc1NCc2ccco2
|
|
575
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
576
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
577
|
c1ccc(cc1)c2ccn3c(c2)ncc3c4cnsc4
|
|
578
|
c1ccc(cc1)Nc2c3cn[nH]c3ncn2
|
|
579
|
CCN(CC)CC#CC1=CCCC1
|
|
580
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
581
|
C(CNCC(F)(F)F)C#N
|
|
582
|
c1ccc(cc1)n2cc(cn2)CSc3nncs3
|
|
583
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
584
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
585
|
Cc1cc(c(nn1)C)SC
|
|
586
|
CC1(OC(=O)C(C(=O)O1)CN/C=C/C2=CCCCC2)C
|
|
587
|
c1cc(ccc1S(=O)(=O)N2C[C@@H]3C[C@@H]4C=C[C@@]3(C2)O4)Cl
|
|
588
|
CC1C(CC(NN1)C2CCCCC2)N(C)C3CCCCC3
|
|
589
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
590
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
591
|
[H]/N=c/n(nc(s1)c2cccs2)CC(=O)c3cccs3
|
|
592
|
Cc1cc(n(n1)CNc2nccs2)C
|
|
593
|
C1=CC=CC(C=C1)NC(=O)N
|
|
594
|
C1C[C@@H](OC1)COCCC#N
|
|
595
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
596
|
Cc1nc(c(o1)Sc2ccc(cc2)Cl)C#N
|
|
597
|
C[C@@H]1CO[S@@](=O)N1C2CCCCC2
|
|
598
|
COc1cc(ccc1O)C=C
|
|
599
|
c1ccc(cc1)C=N2=CC=CC=C2
|
|
600
|
C[C@H]([C@@H]1[C@@H](NC1=O)CC(=O)OC)O
|
|
601
|
CCOC(=O)C1=CNc2ccccc2N=C1N
|
|
602
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
603
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
604
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
605
|
CCOC(=O)N1CCC(=CC1)c2c(nn(c2N)C)C
|
|
606
|
Cc1nc(cs1)[C@@H]2COc3ccccc3O2
|
|
607
|
c1ccc2c(c1)Cc3ccccc3N2
|
|
608
|
Cc1c(non1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)O[C@@H]3CO
|
|
609
|
CCCN1CCC(C1)C(=O)C
|
|
610
|
c1cc(ccc1[C@@H]2CCC=C2)O
|
|
611
|
c1ccc(cc1)C2=NC(=O)CCC2
|
|
612
|
Cc1c(c(n(n1)C(C)(C)C)OC(=O)C)Sc2ccccc2
|
|
613
|
C1COCCC1(CC#N)C#N
|
|
614
|
c1ccc(cc1)SCN2CCOCC2
|
|
615
|
Cc1c(c(n[nH]1)n2ccnc2)N
|
|
616
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
617
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
618
|
Cc1cc(n(n1)CSc2ccccc2)C
|
|
619
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
620
|
C[C@@H](c1ccno1)Oc2ccccc2
|
|
621
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
622
|
COC1CC2C(CC1O)-C3C(CNO3)CCC2
|
|
623
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
624
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
625
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
626
|
COC(=O)[C@@H](c1ccco1)N
|
|
627
|
c1cc2c(nc1)C(=O)c3ccc(cc3CC2)Cl
|
|
628
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
629
|
Cc1nnc(o1)CSc2nccn2C
|
|
630
|
c1ccc(cc1)[C@@H]2C(=N2)c3ccccc3
|
|
631
|
CC#CC(=O)COC/C(=C/C=C)/C
|
|
632
|
Cc1cc(c(c(=O)o1)Sc2ccccc2)[O-]
|
|
633
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
634
|
Cc1ccc(s1)Nc2ccccc2
|
|
635
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
636
|
C[C@@H]1[C@@H](NC2C(CNCN2)N1)C
|
|
637
|
CC1(COC(=N1)/C=C/c2ccccc2)C
|
|
638
|
CC1=NN(C(=O)C1)C(=O)c2ccc(cc2)O
|
|
639
|
Cc1cccc(n1)n2ccnc2
|
|
640
|
C1CSCC1CC2=NCCC3C2SCC3
|
|
641
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
642
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
643
|
|
|
644
|
C1C2C(CC3C1OCO3)N/C(=C/4C=CC=[NH+]4)/C=C2O
|
|
645
|
COC(=O)c1ccc(o1)C#N
|
|
646
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
647
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
648
|
c1cc(oc1)CNc2nnns2
|
|
649
|
c1cnccc1c2nnn(n2)CC#N
|
|
650
|
C1C(=O)CC2NN[NH]N2C1N
|
|
651
|
c1ccc(cc1)Nc2nncs2
|
|
652
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
653
|
COC(=O)c1ccc(o1)[N-]S(=O)(=O)c2ccccc2
|
|
654
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
655
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
656
|
Cc1nccc(n1)Sc2ccccc2
|
|
657
|
C1CC(C(=O)N(C1)CC2NNC(O2)C3CC3)C(F)(F)F
|
|
658
|
c1cc(ccc1F)SN2CCOCC2
|
|
659
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
660
|
C1CCC2C(C1)C(=CN=CO2)O
|
|
661
|
c1ccc2c(c1)CCc3ccccc3NC2
|
|
662
|
Cn1ccnc1COc2ccc(cc2)N
|
|
663
|
c1ccc(cc1)c2cc3c(nccn3n2)Cl
|
|
664
|
c1ccc(cc1)NC[C@@H]2COCO2
|
|
665
|
c1ccc(cc1)S(=O)(=O)Nc2cc3cnnn3c(n2)N
|
|
666
|
COc1ccc2c(c1)C[C@@H]2O
|
|
667
|
CC1(C[C@@H](c2n1ccc2)Nc3ccc(cc3)OC)C
|
|
668
|
Cc1ccccc1SCCN2CCOC2=O
|
|
669
|
CCOC(=O)Cn1nnnn1
|
|
670
|
c1ccc(cc1)Cn2c(=O)ccs2
|
|
671
|
CC(C)([C@@H](Cc1ccc2c(c1O)COC2)O)O
|
|
672
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
673
|
Cc1cc2[nH]c(cc(=O)n2n1)N(c3cc(nn3C(=O)C)C)C(=O)C
|
|
674
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
675
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
676
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
677
|
Cc1nc(cs1)/C=C/c2cccnc2
|
|
678
|
COC(=O)Cc1cccnn1
|
|
679
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
680
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
681
|
c1cc(oc1)COCCC#N
|
|
682
|
CC1=CC(=O)O[C@@H](C1)c2ccccc2
|
|
683
|
CC1(COC(=N1)CCCOc2ccc(cc2Cl)Cl)C
|
|
684
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
685
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
686
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
687
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
688
|
c1ccc(cc1)C2=CCC(=O)O2
|
|
689
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
690
|
c1cc(sc1)c2cncnc2
|
|
691
|
CC1=CC(=O)O[C@@]1(CC(=O)C2CCCCC2)O
|
|
692
|
C[C@@H]1C=C([C@H]2C(=N[NH+]=C2N1)c3ccccc3)C
|
|
693
|
Cc1cc(no1)Cn2cnc(n2)C#N
|
|
694
|
c1ccc(cc1)C2=CC(=O)OC2
|
|
695
|
CC(=O)O/C=C/CC(=O)OC
|
|
696
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
697
|
Cn1cc(cn1)c2cc(on2)CO
|
|
698
|
CC(C)NC(=O)CSc1nnns1
|
|
699
|
Cc1ccoc1NC(=O)OC
|
|
700
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
701
|
c1ccc(cc1)n2cnc3c2cncn3
|
|
702
|
CC1=NN(C(=O)C1)c2ccccc2
|
|
703
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
704
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
705
|
c1ccc(cc1)c2cn3c(n2)SCC(=O)N3
|
|
706
|
c1cc(sc1)C(=O)[C@@H]2CCC(=O)O2
|
|
707
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
708
|
Cn1c(=O)c(cn(c1=O)Nc2ccccc2)C#N
|
|
709
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2ncn3c4ccccc4)O
|
|
710
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
711
|
Cc1ccc(o1)/C=C(C)/CO
|
|
712
|
CC12C(NC(=O)N1)NC(=O)N2
|
|
713
|
C#CCOc1ccc(cc1)F
|
|
714
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
715
|
c1cc(oc1)/C=C/2CCC(=O)O2
|
|
716
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
717
|
CCN1CC(=O)N=C1NCCc2cccc(c2)Cl
|
|
718
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
719
|
C1CCC(CC1)/C=C/2CCCCC(=O)N2
|
|
720
|
Cc1cccc(c1)NC2=NCCO2
|
|
721
|
c1ccc(cc1)SN2CCCCCC2=O
|
|
722
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
723
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
724
|
c1ccc(cc1)S(=O)(=O)[C@@H]2CC(=O)N2
|
|
725
|
c1cc(sc1)CCc2c(cco2)C(=O)[O-]
|
|
726
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
727
|
c1cnc(cn1)NC2=NCCN2
|
|
728
|
CCOC(=O)c1c(c2c([nH]1)cccc2F)N
|
|
729
|
C1CCN(C1)c2c(nns2)CO
|
|
730
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
731
|
C1CCC(CC1)C2=N[C@@H]3C4CCCCC4[C@H]2O3
|
|
732
|
c1ccc(cc1)n2cnc(nc2=[NH2+])N
|
|
733
|
c1ccc(cc1)c2ccccc2
|
|
734
|
CC1=NC(=O)[C@@H](C=C1c2ccc3nccn3c2)C#N
|
|
735
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
736
|
CCOC(=O)c1c([nH]c(=O)[nH]1)C
|
|
737
|
C/C(=C/C=CC=CCc1cnco1)/[C@H](C(C)(C)C(=O)N)O
|
|
738
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
739
|
CCOC(=O)[C@@H](CC#N)C#N
|
|
740
|
CC1=NC[C@@H](O1)c2ccccc2
|
|
741
|
c1ccc(cc1)CN2C=CCCC2=O
|
|
742
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
743
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
744
|
Cc1cc(c(c(=O)o1)Cc2cc(c3cccnc3c2O)Cl)O
|
|
745
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
746
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
747
|
CC(=CCC/C(=C/Cn1ccnc1)/C)C
|
|
748
|
c1ccc(cc1)/C=C/c2csnn2
|
|
749
|
c1ccc2=c3ccccc3=c2c1
|
|
750
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
751
|
Cnccs/c1=NC(=O)Cc2cccs2
|
|
752
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
753
|
C1CCC(CC1)[C@@H]2CCC(=O)N2
|
|
754
|
c1cn(nc1CC(C(F)(F)F)(C(F)(F)F)O)C(=O)N
|
|
755
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
756
|
c1ccc(cc1)S(=O)(=O)n2cncn2
|
|
757
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
758
|
c1ccc(cc1)SCc2cc(=O)c(co2)O
|
|
759
|
COC(=O)c1cc2c(o1)Sc3ccccc3NC2=O
|
|
760
|
c1cc(oc1)C(=O)c2cccs2
|
|
761
|
c1ccc(cc1)c2cc(cc(=O)o2)[O-]
|
|
762
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
763
|
CC(=O)c1cc2cnccc2[nH]c1=O
|
|
764
|
CCOC(=O)N=[S@@](=O)(c1ccccc1)N
|
|
765
|
C[C@@H]1CC2=C(CNc3ccccc3N2)C(=O)O1
|
|
766
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
767
|
Cc1c(non1)c2cc3ccccc3[nH]2
|
|
768
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
769
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
770
|
c1ccc(cc1)C2=NCCNC(=O)C2
|
|
771
|
Cc1ccc(cc1)[C@@H](C/C=C
2c(cc(n2)C)C)O
|
|
772
|
CCCOn1c(nnn1)c2ccccc2
|
|
773
|
C[C@@H]1C(=O)NC2([N-]1)CCCC2
|
|
774
|
CNC(=O)Oc1ccccc1
|
|
775
|
CC(=O)Nc1cc(n[nH]1)c2ccc(cc2)F
|
|
776
|
c1cnoc1c2ccsc2
|
|
777
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
778
|
CC(=O)c1ccc2=c3cc(ccc3=c2c1)C(=O)C
|
|
779
|
C(COCC(F)(F)F)C#N
|
|
780
|
CCOc1c(nc(o1)C#N)C
|
|
781
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
782
|
c1ccc2c(c1)C(=O)Nc3ccccc3N2
|
|
783
|
CC(C)/C=C/C1=CC2=C(C1)Cc3c2cccc3
|
|
784
|
CC1CC(C/C(=[NH+]/C2CCCCC2)/O1)O
|
|
785
|
Cn1cccc1CCn2ccnc2
|
|
786
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
787
|
c1cc(sc1)C2=CC[C@@H](C(=O)N2)C#N
|
|
788
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
789
|
C1CCC(CC1)CON2CCCC2C#N
|
|
790
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
791
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
792
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
793
|
c1c(c2c(cn1)OCCN2)C#N
|
|
794
|
c1ccc(cc1)NC2=NC(=O)CC(=N2)[O-]
|
|
795
|
c1c[nH]c2c1c(cnc2)Cl
|
|
796
|
Cc1ccc(cc1)n2cnnc2
|
|
797
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
798
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
799
|
c1ccc(cc1)[S@](=O)[C@H]2[C@H]3C[C@@H]([C@@H]2O)[C@H]4[C@H]3C=CC4
|
|
800
|
c1ccc(cc1)c2cccnn2
|
|
801
|
CCOC(=O)Cc1[nH]ncn1
|
|
802
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
803
|
Cc1nc-2c(s1)Cc3c2ccc(c3)OC
|
|
804
|
Cn1cc(cn1)c2cnccn2
|
|
805
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
806
|
c1ccc2c(c1)[nH]c(n2)n3cnnc3
|
|
807
|
c1ccc(cc1)Sn2c3ccccc3nn2
|
|
808
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
809
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
810
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
811
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
812
|
CN(CCn1cccn1)c2ccccc2
|
|
813
|
c1ccc2c(c1)ccn2Cc3cnc(s3)Cl
|
|
814
|
CC(C)(C)OC(=O)N1CCc2c(ncnc2Cl)CC1
|
|
815
|
c1cc2c(cc1F)Sc3ccc(cc3CO2)Cl
|
|
816
|
c1ccc(cc1)Cn2cncn2
|
|
817
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
818
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
819
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
820
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
821
|
CCOC(=O)CC/C=C/C#C
|
|
822
|
|
|
823
|
C[C@@H]1CC[C@@H](C1)NC2=NCCO2
|
|
824
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
825
|
[H]/N=c/n(nc(s1)C)Cc2ccccc2
|
|
826
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
827
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
828
|
c1ccnc(c1)SCCn2cccn2
|
|
829
|
Cn1c(=O)n(c(=O)s1)Cc2ccccc2
|
|
830
|
CCCCC#C[C@@H]1CCCO1
|
|
831
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
832
|
CCS(=O)(=O)Nc1cnn(c1C)C
|
|
833
|
CC(C)NC(=O)N[C@H]1COCCO1
|
|
834
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
835
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
836
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
837
|
CC(C)(C)OC(=O)N1CCC(CC1)Cc2cnc[nH]2
|
|
838
|
c1ccn(c1)Nc2ccncc2
|
|
839
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
840
|
Cc1c(snn1)C(=O)N=[S@](=O)(C)c2ccccc2
|
|
841
|
CCC/N=c/1c(c(c1=N/CCC)O)O
|
|
842
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
843
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
844
|
COc1ccc(cc1)/C=C/C(=O)N=C(S2)CC(=O)C3CC3
|
|
845
|
c1cc(cnc1)CNCCc2ccco2
|
|
846
|
CC1(CC(=CNC(=O)C1)c2ccccc2)C
|
|
847
|
c1ccc2c(c1)CNc3ccccc3O2
|
|
848
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
849
|
C1CCC(CC1)Nc2nnns2
|
|
850
|
Cc1nccn1C(=O)c2cccs2
|
|
851
|
CC#CCC/C=C(/C)CCO
|
|
852
|
Cc1cc(=O)[nH]c(n1)C2CC2
|
|
853
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
854
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
855
|
c1ccc2c(c1)N[C@@H](O2)c3cccs3
|
|
856
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
857
|
c1c([nH]nn1)SCC(=O)N
|
|
858
|
C[C@@H](Nc1nccs1)n2cncn2
|
|
859
|
CC(C)(C)OC(=O)[C@@H]1CN(C(=O)N1)C
|
|
860
|
C1[C@@H](NCC1(F)F)C(=O)N
|
|
861
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
862
|
CCn1cc(cn1)c2cncn2CCCC(C)(C)CO
|
|
863
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
864
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
865
|
c1cc(c(nc1)c2ccsc2)N
|
|
866
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
867
|
Cc1c(non1)c2ccn[nH]2
|
|
868
|
c1cn(cn1)[C@@H]2CC([C@@H]3OC[C@H]2O3)(O)O
|
|
869
|
c1c2c(cc3c1OCO3)-c4c(c(=O)c4=O)CC2
|
|
870
|
CN1C/C(=Cc2sccc2)/C(/C(=C/c3sccc3)/C1)O
|
|
871
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
872
|
C1CNNCC1CCC(=O)[O-]
|
|
873
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
874
|
c1ccc(cc1)[C@H]2[C@H]([C@H]3[C@@H](O2)CC(=O)O3)O
|
|
875
|
CC(=O)O[C@@H]1CC([C@H](O1)OCc2ccccc2)(F)F
|
|
876
|
COC(=O)C1=Nn2c3ccccc3nc2CC1
|
|
877
|
CCOSN1CCOCC1
|
|
878
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
879
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
880
|
C1CC2N(C1)[C@@H](OC2=O)C3CCCO3
|
|
881
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
882
|
c1cn(cn1)Cc2cnc(s2)Cl
|
|
883
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
884
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
885
|
CC1=CCCC[C@@H]1Oc2ccccc2
|
|
886
|
c1cc(ncc1C#N)Sc2nccs2
|
|
887
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
888
|
CC1CC2CC3CCCNN3C2NN1
|
|
889
|
c1ccc(cc1)Oc2ccoc2
|
|
890
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
891
|
CC1=COC(=O)c2ccccc2N1
|
|
892
|
C1CC(NNC1)/C=C/C2CCCO2
|
|
893
|
|
|
894
|
c1ccc2c(c1)CCC(=C2)n3ccnc3
|
|
895
|
c1ccc-2c(c1)CCCn3c2nnn3
|
|
896
|
|
|
897
|
c1cc(sc1)CC(=O)n2cnnc2
|
|
898
|
CCS(=O)(=O)n1c(cc(n1)c2ccccc2)N
|
|
899
|
Cc1cnc(o1)c2ccccc2
|
|
900
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
901
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
902
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
903
|
c1ccc2c(c1)CSc3ccccc3N2
|
|
904
|
CC(=O)Nn1c2ccccc2nn1
|
|
905
|
c1ccc(cc1)/C=C/c2cc(cc(=O)o2)[O-]
|
|
906
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
907
|
Cc1cnc(o1)CN2CCOCC2
|
|
908
|
CC(=O)Oc1cc(oc(=O)c1)O
|
|
909
|
Cc1c2cnc3ccccc3n2nn1
|
|
910
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
911
|
CC(C)C(=O)CC1=CC(=O)OC(O1)(C)C
|
|
912
|
c1ccc(c(c1)C(=O)N2CCCS2(=O)=O)F
|
|
913
|
c1ccc(cc1)C#CCNc2[n-]nnn2
|
|
914
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
915
|
CCc1cccc([o+]1)c2ccccc2
|
|
916
|
Cc1[nH]c(=O)cc(n1)CSc2ccccc2
|
|
917
|
c1ccc(cc1)C2=C(C(=O)N3[C@@H]2CCC3)O
|
|
918
|
c1ccc2c(c1)[C@@]3(C(=O)N2)N=C(NC(=N3)N4CCOCC4)N
|
|
919
|
C[C@@]1(COC(=O)N1)[C@@H]2CCc3cc(ccc3C2)O
|
|
920
|
Cc1cccc(c1)NC(=O)n2cccn2
|
|
921
|
CCO[C@@H]1C[C@@H](C=CO1)c2ccccc2
|
|
922
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
923
|
C1CCC2C(C1)OC[C@@H](CS2)O
|
|
924
|
Cc1ccc(cc1)n2ccnc2
|
|
925
|
C/C=C/C=C/C1=CC(=O)CCN1
|
|
926
|
Cn1ccnc1Oc2ccc(cc2)Cl
|
|
927
|
C1CCC(=C(C#N)C#N)NCC1
|
|
928
|
CC1=C(C[S@@](=O)N(C1)C(=O)c2ccccc2)C
|
|
929
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
930
|
c1ccc(cc1)c2cc([nH]c(=O)n2)c3ccccc3O
|
|
931
|
c1ccn(c1)c2ccsc2CO
|
|
932
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
933
|
Cn1cnn2c1nc(c2)c3ccccc3
|
|
934
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
935
|
CC(=O)[C@@H](C1CCCCC1)O
|
|
936
|
COC1NCCC(N1)SC
|
|
937
|
[H]/N=c/n(c2c(s1)CCCC2)CC(=O)c3ccccc3
|
|
938
|
CCOC(=O)Cc1coc(n1)C
|
|
939
|
c1cc2c(c(c1)Cl)nc[nH]2
|
|
940
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
941
|
Cc1cc(cc([o+]1)C)/C=C/c2ccccc2
|
|
942
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
943
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
944
|
c1ccc(cc1)C2=NCC(=O)O2
|
|
945
|
Cc1c(oc(n1)SCC(=O)[O-])C
|
|
946
|
c1ccc(cc1)OCn2ccc(=O)cc2
|
|
947
|
c1ccc(cc1)CSc2ccn[nH]2
|
|
948
|
C[C@@H]1C(=NC(=NC1=O)c2ccccc2)C(=O)[O-]
|
|
949
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
950
|
c1ccc(cc1)[C@@]2(CCn3c4c2cccc4nn3)O
|
|
951
|
Cn1c2cc([nH]c2nc1SC)C(=O)OC
|
|
952
|
c1cc2c(nc1)S[C@@H](NC2=O)c3ccco3
|
|
953
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
954
|
CN1CCN=C(C=C1c2ccccc2O)C(=O)[O-]
|
|
955
|
Cc1cc(no1)c2nnnn2c3ccc(cc3)F
|
|
956
|
|
|
957
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
958
|
Cc1cc(n(n1)CCc2nnc(n2C)SC)C
|
|
959
|
CC1NC2C(CN(N2)CC3CCCCC3)C(=O)O1
|
|
960
|
Cc1nc(no1)CSc2ccccc2
|
|
961
|
COc1cccc(n1)[C@H]2CCC(=O)NC2
|
|
962
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
963
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
964
|
c1ccc(cc1)c2cc3ccsc3o2
|
|
965
|
COC(=O)NC1(OCCO1)C(F)(F)F
|
|
966
|
COC(=O)c1c(c2c([nH]1)c3ccccc3n4c2nnn4)N
|
|
967
|
CSc1nnc2n1[nH]cn2
|
|
968
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
969
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
970
|
c1ccc(cc1)Cn2ccnn2
|
|
971
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
972
|
c1ccc(cc1)[C@@H]2CCC(=O)O2
|
|
973
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
974
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
975
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
976
|
c1ccc(cc1)[C@@H]2C(=O)NC(=O)O2
|
|
977
|
COc1ccccc1/N=c/2cccccc2O
|
|
978
|
c1c(cnc2c1COC(=O)N2)Br
|
|
979
|
Cc1c(cc(o1)c2ccno2)S(=O)(=O)NC
|
|
980
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
981
|
COc1ccc(cc1)C2=COc3ccccc3C(=O)N2
|
|
982
|
C1CCC(CC1)C2CCNS2
|
|
983
|
CN1Cc2ccccc2NC1=O
|
|
984
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
985
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
986
|
C[C@@H]1COC(=N1)c2cccs2
|
|
987
|
c1ccc(cc1)CO[C@@H]2C=CC=CO2
|
|
988
|
c1cc2c(cc1c3ccc(s3)C(=O)N)NCCO2
|
|
989
|
c1cc(sc1)c2cc3c(=O)[nH]ncn3n2
|
|
990
|
CCc1nc(cs1)CSc2nccn2C
|
|
991
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
992
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
993
|
c1cc([nH]c1)C(=O)c2ccco2
|
|
994
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
995
|
Cn1c(cc(n1)C(=O)OC)OC(=O)c2ccco2
|
|
996
|
c1cnn(c1)Cn2cc(cn2)N
|
|
997
|
CN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)NC1=O)O
|
|
998
|
c1ccc2c(c1)C(=O)Nc3ccccc3S2
|
|
999
|
Cc1csc(n1)Sc2nc(ns2)Cl
|
|
1000
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
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