(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CC1CC2CC3CCCNN3C2NN1
|
|
2
|
CC1CCCC(N1)C2[N-]NNN2
|
|
3
|
Cc1ccc(nc1)n2cnnn2
|
|
4
|
Cc1cc(nn1C)c2nnc(s2)NC
|
|
5
|
c1cc(nnc1n2cnnn2)Cl
|
|
6
|
Cc1csc2n1c-3nc4ccccc4c3nn2
|
|
7
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
8
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
9
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
10
|
c1ccc2c(c1)nc(c(=O)o2)N
|
|
11
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
12
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
13
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
14
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
15
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
16
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
17
|
C#Cc1cc2ccccc2nc1
|
|
18
|
c1ccc2c(c1)nnn2c3nnns3
|
|
19
|
c1ccc2c(c1)nnn2C3=NCCCC3
|
|
20
|
C1CCC(CC1)C2NNC(O2)C3C4CCCCC4SN3
|
|
21
|
CNC1CNC2CCCCC2N1
|
|
22
|
Cc1ccc(cc1)c2nnco2
|
|
23
|
CN1c2ccccc2Oc3c1cc(nn3)Cl
|
|
24
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
25
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
26
|
c1cc2c(c(c1)O)nnn2[O-]
|
|
27
|
c1cc(oc1)OC(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
28
|
c1ccc2c(c1)Nc3c(cc(nn3)Cl)S2
|
|
29
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
30
|
Cc1cn(nn1)c2ccccc2
|
|
31
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
32
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
33
|
c1c(=O)nc2n(n1)c(cs2)N
|
|
34
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
35
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
36
|
c1cc(c2nncn2c1)Cl
|
|
37
|
C1CCC2C(C1)NC3C(N2)NSN3
|
|
38
|
COC(=O)Nc1cn2ccccc2n1
|
|
39
|
COC1NC2CCCCC2NN1
|
|
40
|
c1ccc(cc1)c2c3ccccn3nn2
|
|
41
|
CC1([C@@H]2CC[C@]1(c3c2nc(c(n3)C#N)C#N)C(=O)[O-])C
|
|
42
|
c1ccc(cc1)c2cccnn2
|
|
43
|
c1ccc(cc1)c2c3c(on2)CCNC3
|
|
44
|
c1ccc2c(c1)nc(o2)n3c4ccccc4oc3=O
|
|
45
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
46
|
Cn1c2nnc(n2nn1)c3ccccc3
|
|
47
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
48
|
Cc1cc(n(n1)c2nc3c(c4ccccc4[nH]3)nn2)C
|
|
49
|
CCNC(=O)Oc1c2ccccc2on1
|
|
50
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
51
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
52
|
C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2COC3=O
|
|
53
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
54
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
55
|
c1cc2c([nH]nc2Cl)nc1
|
|
56
|
C1CCC2C(C1)CC3=NC(=O)N=C23
|
|
57
|
Cc1ccc2nc(=O)on2c1
|
|
58
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
59
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
60
|
Cc1nc(cs1)c2nnc(o2)N
|
|
61
|
Cc1cc(cc2n1nnn2)O
|
|
62
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
63
|
C#Cc1ccc2c(c1)nccn2
|
|
64
|
c1cc2c(c(c1)Cl)C(=O)C2
|
|
65
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
66
|
CC(=O)Nc1ccc2c(c1)ccs2
|
|
67
|
c1ccc2c(c1)nc(c3n2nnn3)N
|
|
68
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
69
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
70
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
71
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
72
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
73
|
C[C@@H]1CSc2c1ncc(c2)C(=O)OC
|
|
74
|
C[C@@H]1[C@@H](C(=O)OC1(C)C)c2[n-]nnn2
|
|
75
|
COC(=O)n1c(=O)c2ccccc2o1
|
|
76
|
CCOC(=O)c1cc2c3ccccc3oc2s1
|
|
77
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
78
|
c1c2c(n3c(n1)ncn3)CCC2
|
|
79
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
80
|
C1CC2C(C(N[NH]C2=O)[O-])C1
|
|
81
|
CC1(OC[C@@H](O1)CC(=O)N)C
|
|
82
|
c1coc2c1cc(cc2O)F
|
|
83
|
c1c(c(c(c(n1)F)F)F)F
|
|
84
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
85
|
c1cc2c(c(c1)F)C(=O)CC2
|
|
86
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
87
|
c1ccn(c1)c2[n-]c(nn2)C(=O)[O-]
|
|
88
|
c1ccc2c(c1)n3c(s2)nnn3
|
|
89
|
Cc1nnc(s1)c2cc3ccccc3n2C
|
|
90
|
c1ccc2c(c1)ncc(n2)C#N
|
|
91
|
CC(=O)Nc1coc2c1cccc2
|
|
92
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
93
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
94
|
Cc1cc2c(c(=O)o1)[C@@H](CO2)O
|
|
95
|
c1cc2c(cc1Cl)con2
|
|
96
|
c1ccc(cc1)C(=O)c2c3ccccn3nn2
|
|
97
|
CSc1nc2c(cc(s2)c3ccccc3)nn1
|
|
98
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
99
|
c1ccc(cc1)c2nncnn2
|
|
100
|
Cc1nn2cc(nc2s1)NC(=O)OC
|
|
101
|
c1cc2c(nc1)OCC(=O)N2
|
|
102
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
103
|
CN(C)C(=O)Nc1[n-]nnn1
|
|
104
|
c1cc2c(c(c1)F)c(nc3n2nnc3C#N)N
|
|
105
|
c1cc(=O)oc2c1cc3c(c2O)OCC3
|
|
106
|
c1cc2c(cc1O)COC2=O
|
|
107
|
C1Cc2c(non2)C(=O)NC1
|
|
108
|
c1ccc2c(c1)nc3c(n2)Sc4c(cccn4)O3
|
|
109
|
c1c(cnnc1[O-])C(F)(F)F
|
|
110
|
c1c2c(n[nH]c1=O)CCCC2
|
|
111
|
CCOc1nnc(s1)CN2CCOCC2
|
|
112
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
113
|
c1c2c(nc(n1)N)SCC2
|
|
114
|
c1cc2c(nc1)sc(=O)o2
|
|
115
|
c1ccc2c(c1)nc3c(n2)nc[n-]3
|
|
116
|
c1ccc2c(c1)nnn2Cc3nc4ccccc4o3
|
|
117
|
Cc1nnc(s1)c2ccccc2
|
|
118
|
CC(=O)Nc1cc(n[nH]1)c2ccc(cc2)F
|
|
119
|
C1CCC(CC1)C2C3C(NO2)CCC3
|
|
120
|
C1CCc2c(nc(nn2)N)C1
|
|
121
|
c1cc(ccc1n2c(=O)n3c(n2)NCCC3)F
|
|
122
|
c1c(=O)nc2n(n1)C(=O)CS2
|
|
123
|
c1cc2c(c3c1nncc3)non2
|
|
124
|
CC(C)(C)OC(=O)N1Cc2c(nc[nH]2)C1
|
|
125
|
C1C2CONC2CC3C1OCO3
|
|
126
|
Cc1c2cnc3ccccc3n2nn1
|
|
127
|
C1C2CC3CC1CC(C2)C3=O
|
|
128
|
|
|
129
|
|
|
130
|
Cc1c(cno1)c2cn3ccccc3n2
|
|
131
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
132
|
Cc1c2c(n[nH]1)COC(=O)N2
|
|
133
|
Cc1ccc(cc1)n2cnnn2
|
|
134
|
c1c(cc(c2c1CC=C2)F)F
|
|
135
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
136
|
c1ccc2c(c1)c3n(n2)C(=O)c4ccccc4C3=O
|
|
137
|
C1C(C(C2C(C1F)N[NH]N2)N)F
|
|
138
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
139
|
c1c(c(nc(c1F)[O-])[O-])C#N
|
|
140
|
Cc1c2c(n[nH]1)CC(C=C2)(C)C
|
|
141
|
C1C2=C[C@@H]3C=C[C@H]2[C@@H](C=C3)NC1=O
|
|
142
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
143
|
c1ccc(cc1)c2nnc3n2CCCS3
|
|
144
|
c1cc2c(=O)[nH]nc(n2c1)[O-]
|
|
145
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
146
|
c1ccc(cc1)c2nc(on2)c3csnn3
|
|
147
|
[H]/N=c/n(c2c(s1)nc3ccccc3n2)N
|
|
148
|
c1cnc(cn1)c2nnc(o2)N
|
|
149
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
150
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
151
|
Cc1ccc2c(c1)nnc(n2)N
|
|
152
|
CCCc1nc([nH]n1)c2ccccc2O
|
|
153
|
Cc1nnnn1C2CCCCC2
|
|
154
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
155
|
CCC(=O)N/C=C/c1ccccc1
|
|
156
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
157
|
CC1NC(ON1)[C@@H]2CCC=CC2
|
|
158
|
c1ccc(cc1)n2c3c(c(ncn3)[O-])nn2
|
|
159
|
Cc1nnc(o1)[C@H]2CCN(C2)C(=O)C
|
|
160
|
Cc1cc2c(cco2)c(=O)n1N
|
|
161
|
C1Cc2nnc(n2C1)C(=O)[O-]
|
|
162
|
c1cc(c(cc1c2cn(nn2)C3CCCCC3)Cl)Cl
|
|
163
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
164
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
165
|
c1ccc(cc1)n2c(=O)c-3c4n(nnc3n2)CCC4
|
|
166
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
167
|
C1C[C@@H](OC1)c2nnc(o2)N
|
|
168
|
C[C@@H]1CCC2C(C(=O)[NH]C(N2)N)N1
|
|
169
|
CCOC(=O)c1cccnn1
|
|
170
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
171
|
COC(=O)Nc1cn2c(n1)ccc(n2)C(=O)N
|
|
172
|
Cc1c2c(nc(n1)n3cc(nn3)c4ccccc4)CCCC2
|
|
173
|
|
|
174
|
c1c(cnc2c1CCCC2)C#N
|
|
175
|
c1ccc2c(c1)c(=O)n-3c(n2)C(=O)c4c3cccc4
|
|
176
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
177
|
c1nc(nn1CC(F)(F)F)N
|
|
178
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
179
|
Cc1c2c(n3c(n1)nnn3)CCC2
|
|
180
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
181
|
CNc1c2c(nc(n1)N)non2
|
|
182
|
C1[C@@H](NCC1(F)F)C(=O)N
|
|
183
|
c1ccc(cc1)c2cn(nn2)c3ccccc3
|
|
184
|
C1Cc2c(non2)-c3c1non3
|
|
185
|
C[C@H]1[C@H]2CC[C@H](O2)[C@@]([C@@H]1O)(C)Cl
|
|
186
|
C1CCC(C1)C(=O)Nc2[n-]nnn2
|
|
187
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
188
|
c1ccc(cc1)n2cnc(n2)[O-]
|
|
189
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
190
|
c1ccc2c(c1)c(nnn2)Nc3ccccc3Cl
|
|
191
|
C1CCC2(CC1)CNC(=O)O2
|
|
192
|
c1cc2c(cc1O)CC(=O)O2
|
|
193
|
CNc1cnnc2c1cccc2
|
|
194
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
195
|
c1ccc2c(c1)nc3c(n2)Oc4ccccc4N3
|
|
196
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
197
|
Cc1[nH]c2c(n1)C(=O)CCC2
|
|
198
|
C1CCn2c(nnc2CC#N)C1
|
|
199
|
CCOC(=O)C1=NC2=CCn3ccnc3C2=C1
|
|
200
|
c1c(=O)[nH]c2c(n1)CCCC2
|
|
201
|
CN1CCN(c2c1c(=O)c2=O)C
|
|
202
|
c1ccc(cc1)NC(=O)Nc2ccno2
|
|
203
|
C1=CC=CC(C=C1)NC(=O)N
|
|
204
|
C1C[C@@H](OC1)C(=O)Nc2[n-]nnn2
|
|
205
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
206
|
Cc1csc(n1)c2cc3ccccc3oc2=O
|
|
207
|
Cc1cc2c3nnnn3cnc2s1
|
|
208
|
Cncc([nH]/c1=NC(=O)C23CC4CC(C2)CC(C4)C3)[O-]
|
|
209
|
C/C(=C/C(=O)[O-])/C(F)(F)F
|
|
210
|
c1nc2n(n1)C[C@@H](CS2)O
|
|
211
|
Cc1c(snn1)c2nnc(o2)C3CCCCC3
|
|
212
|
c1c2c(nc(n1)N)CCOC2
|
|
213
|
c1nc2n(n1)C(=O)CC(=N2)[O-]
|
|
214
|
CC(=C)c1nc(co1)C(=O)[O-]
|
|
215
|
Cc1c(c(n[nH]1)n2ccnc2)N
|
|
216
|
CC1C2C(NNC1NC(=O)C)C[C@@H](C2)C(=C)C
|
|
217
|
CC1=C(Cc2c(c(=O)c2=O)C1)C
|
|
218
|
C1C[C@H]2[C@@H]3C=C[C@H]([C@@H]1C2=O)O3
|
|
219
|
Cc1c2c(nc(n1)N)OCC2
|
|
220
|
CC1=Cn2c3ccccc3nc2CO1
|
|
221
|
c1cc([nH]c1)/C=C/c2cccs2
|
|
222
|
c1ccn2c(c1)nn(c2=O)CC#N
|
|
223
|
Cc1ccc(cc1)c2[n-]nnn2
|
|
224
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
225
|
c1cc2c(nc1)ssc2=O
|
|
226
|
C1C=C2C(=CC(=O)O2)[C@@H](O1)O
|
|
227
|
c1c2c(n[nH]c1=O)CCOC2
|
|
228
|
c1cc2ccnn2c(c1)Br
|
|
229
|
CC1=CC(=O)Nc2cncnc2N1
|
|
230
|
c1cc2c(c(c1)Cl)[nH]nn2
|
|
231
|
c1csc2c1c(n[nH]c2=O)N
|
|
232
|
c1ccc2c(c1)-c3cccnc3C2=O
|
|
233
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
234
|
c1ccc2c(c1)c(=O)sc(n2)N
|
|
235
|
CC(C)(C)OC(=O)Nc1cc2c(nc1)n(cn2)C
|
|
236
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
237
|
COC(=O)c1csc2c1nns2
|
|
238
|
C1C2C(NCN1)SC=C(N2)O
|
|
239
|
c1c[nH]nc1c2nccs2
|
|
240
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
241
|
Cc1c(nc2c(n1)cccn2)C
|
|
242
|
c1cnn2c1nc(cc2)Cl
|
|
243
|
c1ccc(cc1)c2ncc(o2)c3ncco3
|
|
244
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
245
|
c1cc(cc(c1)N)c2cocn2
|
|
246
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
247
|
c1ccc-2c(c1)CCc3c2n[nH]c3
|
|
248
|
c1ccc(cc1)c2nc(no2)c3nnc(o3)N
|
|
249
|
CC1(COC(=N1)/C=C/c2ccccc2)C
|
|
250
|
c1cc2c3c(c1)OCc3cc(=O)o2
|
|
251
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
252
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
253
|
CC1(c2cccnc2NC1=O)C
|
|
254
|
CC1NC(ON1)C2CNCCN2
|
|
255
|
c1nc2nc(nc(n2n1)N)[O-]
|
|
256
|
c1cc2c(nc1C#N)CCCN2
|
|
257
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
258
|
c1cscc1c2nnc(o2)N
|
|
259
|
CN1CCn2c3ccccc3nc2C1
|
|
260
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
261
|
Cc1cc(nc2c1c(c(o2)C(=O)C)N)C
|
|
262
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
263
|
C(#N)C(C(C#N)(F)F)(F)F
|
|
264
|
CC1NNC2N1CC[NH]C2=O
|
|
265
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
266
|
C[C@@H]1[C@@H](Nn2c(nnn2)N1)C
|
|
267
|
c1ccc(cc1)c2c3c(non3)on2
|
|
268
|
CN1C2CCNC(C2NN1)CL
|
|
269
|
c1cc(sc1)c2nnco2
|
|
270
|
c1ccc2c(c1)nc3c(noc3n2)[O-]
|
|
271
|
C1CCN(CC1)c2[n-]nnn2
|
|
272
|
c1c2cc(oc2ncc1F)CO
|
|
273
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
274
|
c1cc(oc1)CNc2[n-]nnn2
|
|
275
|
c1ccc(cc1)c2ncc(o2)C3=NCCO3
|
|
276
|
c1cc(nn2c1ncc2)Cl
|
|
277
|
c1c(noc1N)C2CCCC2
|
|
278
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
279
|
C1COC(=O)[C@@H]1C(F)(F)F
|
|
280
|
c1cc(sc1)c2cc(c(nn2)O)NC(=O)C3CCC3
|
|
281
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
282
|
Cc1c(=O)n2ccccc2nn1
|
|
283
|
Cc1cc(no1)c2ccccc2
|
|
284
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
285
|
Cc1csc(n1)c2nnc(o2)N
|
|
286
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
287
|
c1cc2c(c(c1)Cl)nc[nH]2
|
|
288
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
289
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
290
|
CCCOn1c(nnn1)c2ccccc2
|
|
291
|
C=Cc1nc(cs1)C(=O)[O-]
|
|
292
|
CCOC(=O)c1cnc2c3c1onc3CCC2
|
|
293
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
294
|
c1ccc2c(c1)oc(=O)c(=O)o2
|
|
295
|
Cn1c(ccn1)CNC(=O)Cn2cccnc2=O
|
|
296
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
297
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
298
|
CSc1c(cccn1)C#N
|
|
299
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
300
|
C1CCc2c(nc(s2)N)C1
|
|
301
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
302
|
Cn1c(=O)c2ccccc2nn1
|
|
303
|
CC(C)Oc1cc(on1)c2[n-]nnn2
|
|
304
|
c1cc(cnc1)Br
|
|
305
|
C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]2C(=O)O1)O3
|
|
306
|
Cc1nc(no1)c2ccccc2
|
|
307
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
308
|
CC(=O)N1CCC(CC1)c2nnc(s2)c3ccco3
|
|
309
|
C1CN2C=CN=C(C2=N1)Cl
|
|
310
|
CC(C)(C#N)NC(C)(C)C#N
|
|
311
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
312
|
Cc1cc2c(cco2)c(=O)o1
|
|
313
|
COC(=O)C#Cc1ccccn1
|
|
314
|
c1coc2c1c(=O)[nH]nc2[O-]
|
|
315
|
CC#CC#Cc1cccc(=O)o1
|
|
316
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
317
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
318
|
CCOC(=O)/C=C/1C2NNNN2-C3CCCCC3N1
|
|
319
|
Cc1c(c(no1)/C=C/c2ccc(cc2)F)N
|
|
320
|
c1cnccc1c2nnn(n2)CC#N
|
|
321
|
Cc1cc2ncc(cn2n1)C#N
|
|
322
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
323
|
c1c(nc(cn1)Cl)n2cncn2
|
|
324
|
c1ccc(cc1)c2cn3c(n2)scn3
|
|
325
|
c1ccc2c(c1)c(c[nH]2)c3c(=O)[nH]c4ccccc4n3
|
|
326
|
Cc1cc(nc(n1)Nc2cc(on2)C)C#N
|
|
327
|
c1ccc2c(c1)c3c(o2)CNCC3
|
|
328
|
c1ccc(cc1)/C=C/c2csnn2
|
|
329
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
330
|
c1ccc2=NC3=[NH+]CCN3C(=c2c1)[O-]
|
|
331
|
CCOC(=O)/[NH+]=c/cc(cc(o1)O)O
|
|
332
|
c1ccc2c(c1)c(=O)oc3n2nc4c3CCCC4
|
|
333
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
334
|
c1cc2c(nc1)Nc3c(c(=O)nc([nH]3)N)S2
|
|
335
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
336
|
c1ccc(cc1)OCn2ccc(=O)cc2
|
|
337
|
c1c(nc(=O)n(n1)[C@@H]2CCCO2)N
|
|
338
|
c1[nH]c2c(n1)C(=O)C[NH+]=CN2
|
|
339
|
CC1=Nc2c(non2)N=C(C1)C
|
|
340
|
C=CCNC1CCNC(N1)N
|
|
341
|
c1ccc(cc1)C#Cc2cccs2
|
|
342
|
c1cc2c(cc1F)O[C@@H](S2)N
|
|
343
|
COC(=O)Cc1cccnn1
|
|
344
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
345
|
c1ccc2c(c1)nnn2Cn3cccc3
|
|
346
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
347
|
CC(=O)O/C=C/c1ccccc1
|
|
348
|
C(C(F)(F)F)C(F)(F)F
|
|
349
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
350
|
Cc1c[nH]/c(=NC(=O)OC(C)(C)C)/[nH]1
|
|
351
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
352
|
|
|
353
|
c1c(nc2cnnn2c1[O-])[O-]
|
|
354
|
COC(=O)C1CSCCC1=O
|
|
355
|
CC(=O)N(C)c1cccnc1
|
|
356
|
Cc1c(nn(n1)C(=O)c2ccccc2)C
|
|
357
|
CCCOC(=O)n1cccc1
|
|
358
|
c1cc2c(c(c1)F)CC(=O)N2
|
|
359
|
c1cncc2c1sc(n2)Cl
|
|
360
|
Cc1cc(c(o1)C)c2cc[nH]n2
|
|
361
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
362
|
CC1NC(ON1)C2CCCO2
|
|
363
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
364
|
Cc1cc(=O)n2c(n1)nc(c(n2)C)[O-]
|
|
365
|
c1cc(=O)oc2c1cc3c(c2O)OC=CC3
|
|
366
|
C1CCC2C(C1)C(=CN=CO2)O
|
|
367
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
368
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
369
|
Cc1c(ccc(n1)Cl)C#N
|
|
370
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
371
|
c1ccc(cc1)c2nccnn2
|
|
372
|
CC(=O)N[C@@H]1Cc2c1cccc2
|
|
373
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
374
|
|
|
375
|
c1ccc2c(c1)nnn2c3nc4ccccc4s3
|
|
376
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
377
|
COC1=CC=C/C(=C/2NNN=N2)/C1=O
|
|
378
|
c1ccn(c(=O)c1)OCC(=O)[O-]
|
|
379
|
Cc1nnc2n1nc(n2c3ccccc3)[O-]
|
|
380
|
CNC(=O)Oc1ccccc1
|
|
381
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
382
|
COC1CCC(CC1)C2NNC3N2SC4C3CCCC4
|
|
383
|
c1ccc-2c(c1)CCc3c2nnn3c4ccc(cc4)Br
|
|
384
|
Cc1cc(n2c(n1)nnn2)[O-]
|
|
385
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
386
|
c1ccc2c(c1)c(=O)n(s2)c3nccs3
|
|
387
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
388
|
Cc1nnc2n1C[C@@H](S2)C
|
|
389
|
Cc1cccc(c1)NC(=O)N2C[C@@H]3C[C@H]2C=C3
|
|
390
|
Cc1c(non1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)O[C@@H]3CO
|
|
391
|
c1cn2c(c1CO)[C@@H](CC2)O
|
|
392
|
c1cc2c(c3c1noc3)nco2
|
|
393
|
|
|
394
|
c1cc(oc1)CNc2nnns2
|
|
395
|
Cn1cnc(c1C#N)n2oo2
|
|
396
|
c1ccc(cc1)C(=O)C(O)O
|
|
397
|
c1c(c(=O)nc2n1CCO2)C#N
|
|
398
|
c1csc(n1)C(=O)CC#N
|
|
399
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
400
|
CN1CC2C(N1)CNN(C2=O)C
|
|
401
|
Cc1nnnn1[C@@H]2CC(=O)[C@H]3OC[C@@H]2O3
|
|
402
|
c1nc(c(n1CCO)N)C#N
|
|
403
|
c1cocc1c2nc(no2)C(=O)[O-]
|
|
404
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
405
|
c1cnnc2c1-c3c(non3)CC2
|
|
406
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
407
|
C1=C[C@@]2([C@@H]3[C@@H]([C@H]1O2)C(=NC3=O)[O-])CO
|
|
408
|
C1C=C2C(=C[C@@]1(CCO)N)OCO2
|
|
409
|
c1cc2c(nc1)nc(o2)N3CCCC3
|
|
410
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
411
|
c1ccc2c(c1)c(=O)c-3nc(=O)nc23
|
|
412
|
c1ccc2c(c1)nnn2Cc3nc4ccccc4s3
|
|
413
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
414
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
415
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
416
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
417
|
C1CSCC1C2[NH]NC(N2)C3CCSC3
|
|
418
|
c1ccc(cc1)C2=NC(=O)CN2
|
|
419
|
c1ccc2c(c1)ncn2C3=NCCN3
|
|
420
|
Cc1cc(n2c(n1)ncn2)[O-]
|
|
421
|
Cc1c(c(=O)n([nH]1)C)CCO
|
|
422
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
423
|
c1ccc(c(c1)c2nnco2)O
|
|
424
|
c1cnn2c1N[C@H](CC2=O)CO
|
|
425
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
426
|
c1ccc(cc1)Oc2c(non2)N
|
|
427
|
c1cc(oc1)c2ccc(nc2)C#N
|
|
428
|
Cc1c(non1)c2cc3ccccn3c2
|
|
429
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
430
|
c1ccc(cc1)COn2cc(cn2)I
|
|
431
|
Cc1cc(=O)n2n1c3ccccc3nn2
|
|
432
|
c1c2c(nc(n1)N)CCCC2=O
|
|
433
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
434
|
Cn1c2ccccc2n3c1n[nH]c3=O
|
|
435
|
Cc1c(cc2cc[nH]c2n1)C#N
|
|
436
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
437
|
C=CC[C@@H]1C(=NC(=NC1=O)N)O
|
|
438
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
439
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
440
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
441
|
CCOC(=O)C1=C(C(=O)N(C1)c2ccccc2)N
|
|
442
|
Cn1c(=O)[nH]c(=O)c(n1)C#N
|
|
443
|
c1ccc2c(c1)nc3n2C=CC3
|
|
444
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
445
|
Cc1c(sc(n1)c2c(n(nn2)c3ccccc3)C)C(=O)[O-]
|
|
446
|
Cc1cccc(n1)n2ccnc2
|
|
447
|
c1ccc(cc1)C(=O)NC2=NC(=O)[C@@H]3C(=N2)[N-]C=N3
|
|
448
|
Cc1conc1n2c(=O)nc3ccccc3n2
|
|
449
|
CCSc1nnc2n1CCN2c3ccccc3
|
|
450
|
c1con2c1nc(c2)C(=O)[O-]
|
|
451
|
c1nnc2n1NC(=O)CS2
|
|
452
|
C[C@@H]1[C@@H](NC2C(CNCN2)N1)C
|
|
453
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
454
|
CC(=O)Nc1c-2sscc2n(c1=O)C
|
|
455
|
c1ccn2c(c1)nc3c2cc(s3)C(=O)[O-]
|
|
456
|
c1cc(cnc1)C2=NC(=O)C3(N2)CCCC3
|
|
457
|
c1ccc2c(c1)CN3CCNC3=N2
|
|
458
|
c1ccc(cc1)C(=O)Nc2cc[nH]n2
|
|
459
|
c1ccc2c(c1)OCC(=O)O2
|
|
460
|
C1C=CN(C(=O)N1CO)CO
|
|
461
|
C1CCC(CC1)NSC2CCCCC2
|
|
462
|
c1cc2c(cc1F)C(=O)NC2
|
|
463
|
c1csc2c1ncnc2N
|
|
464
|
c1cc2c(cc1N)c3c(o2)CCC3
|
|
465
|
C#CCn1cnc2c1cccc2
|
|
466
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
467
|
COc1c2c([nH]n1)nncn2
|
|
468
|
Cc1c2cnnc(n2cn1)Nc3cccnc3
|
|
469
|
Cc1cc(nn2c1nnc2)O
|
|
470
|
COc1c2cn[nH]c2ncn1
|
|
471
|
Cc1c2c(ccc(n2)NC(=O)C)n(n1)C
|
|
472
|
C(C(C(F)(F)F)(F)F)O
|
|
473
|
C[C@@H]1C(=C(Nc2n1c3ccccc3n2)C)C(=O)OC
|
|
474
|
c1ccc2c(c1)[nH]c(=O)n2c3nc4c(o3)cccn4
|
|
475
|
c1cc(cc2c1cc[nH]2)Cl
|
|
476
|
c1ccc2c(c1)nc3c(c(oc3n2)N4CCCC4)C#N
|
|
477
|
c1ccc(cc1)c2nnc3n2CCCC3
|
|
478
|
CCOC(=O)Nc1nc2ccn(c2s1)C
|
|
479
|
C#Cc1ccc(s1)C(=O)[O-]
|
|
480
|
c1c(c(n(n1)C(=O)CCN2CCOC2=O)N)C#N
|
|
481
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
482
|
C1CN2C=Nc3c(c(no3)C(=O)[O-])C2=N1
|
|
483
|
Cc1csc2n1nc(n2)N
|
|
484
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
485
|
Cc1cc(nc2c1c(on2)N)C
|
|
486
|
CC1(Cc2c(nc(c(n2)N)C(=O)OC)CO1)C
|
|
487
|
c1ccc2c(c1)CC(=C2)n3ccnc3
|
|
488
|
CC1=Nn2c(nnc2N=C(C1)O)N
|
|
489
|
c1cnnc(n1)c2nccnn2
|
|
490
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
491
|
Cn1cnc2c(c(nn2c1=O)C#N)C#N
|
|
492
|
Cc1cc(nc(n1)n2c3c(cn2)C(=O)CCC3)C
|
|
493
|
c1cc2cccc3c2c(c1)C(=O)O3
|
|
494
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
495
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
496
|
Cc1cc(c(nn1)[O-])c2nc3ccccc3n2C
|
|
497
|
c1ccc(cc1)C2=NCC(=O)O2
|
|
498
|
c1ccc(cc1)c2cc(on2)[C@@]3(CC[C@H]4CO[C@@H]3O4)O
|
|
499
|
Cc1c(c(nc(=O)o1)[O-])c2ccccc2F
|
|
500
|
CSc1cnc2ccccc2n1
|
|
501
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
502
|
CNC1=N[C@@H]2CCCC[C@@H]2O1
|
|
503
|
Cc1cc2nc(nc(n2n1)N)N
|
|
504
|
Cc1ccc(cc1)n2cccn2
|
|
505
|
c1cscc1OC(=O)C2=NC(=O)CC=C2
|
|
506
|
c1cnc(c2c1n3c(ccn3)nn2)[O-]
|
|
507
|
[H]/N=c/1[nH]nc2c(n1)-c3ccccc3C2=O
|
|
508
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
509
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
510
|
|
|
511
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
512
|
CC1(NC(=O)[C@@H](O1)/C=C/C2CCCCC2)C
|
|
513
|
c1ccc2c(c1)c3cc(nn3c(n2)[O-])c4ccccn4
|
|
514
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
515
|
c1cc(cnc1)[C@@]2(CCC=C2)O
|
|
516
|
CC(=O)OC1C2C=CC1C=C2
|
|
517
|
CC1=CC(=O)Nc2ccccc2N1
|
|
518
|
|
|
519
|
c1ccc2c(c1)nc(o2)c3ccco3
|
|
520
|
c1cc(sc1)NC(=O)NCC2CC2
|
|
521
|
CCOC(=O)N1CC2CCOC2C1
|
|
522
|
c1nc2c3n1CCN=C3NC=N2
|
|
523
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
524
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
525
|
C1C2CC3CC1OC(O2)(O3)C(=O)N
|
|
526
|
C1C(NC2N1CCS2)CL
|
|
527
|
C1[C@@H]2C[C@@]([C@H]1C=C2)(C#N)Cl
|
|
528
|
CSc1nc(c(s1)C#N)N
|
|
529
|
c1c2cc(nc(c2c(nc1O)O)O)O
|
|
530
|
Cc1nnc2n1nc(s2)C
|
|
531
|
C1CCCC(=CC(=O)N)CC1
|
|
532
|
CC1NC(ON1)C2CCC3C(C2)SCN3
|
|
533
|
c1cocc1c2nc([nH]n2)N
|
|
534
|
c1c(cnc2c1non2)Br
|
|
535
|
c1ccc2c(c1)c(=O)c(=N3=CC=CC=C3)c2=O
|
|
536
|
CC(=O)c1ccc-2c(c1)-c3c2cccc3
|
|
537
|
c1cc(sc1)c2c[nH]nc2
|
|
538
|
c1ncn(n1)C(=O)NC2CCCCC2
|
|
539
|
c1ccc(cc1)/C=C/c2cccs2
|
|
540
|
c1cc2c(c3c1non3)nns2
|
|
541
|
c1nnc2n1nc3c(c2[O-])CCC3
|
|
542
|
c1ccc(cc1)C#CC#CC#N
|
|
543
|
Cc1cc2n(c(=O)c1C#N)CCO2
|
|
544
|
c1ccc(cc1)OCc2nnco2
|
|
545
|
Cc1nc(no1)c2cccs2
|
|
546
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
547
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
548
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
549
|
C/N=C/N(C2C(S1)NC(C(N2)C#N)C#N)C
|
|
550
|
c1cc(sc1)CCNc2ncccn2
|
|
551
|
Cc1c2cc3c(nc2n(n1)C)C(=O)OCC3
|
|
552
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
553
|
c1cc(sc1)c2cc3c(=O)[nH]ncn3n2
|
|
554
|
CC(=O)[C@@H]1C[C@H]2CC[C@@H]1C=C2
|
|
555
|
C1CC(NNC1)/C=C/C2CCCO2
|
|
556
|
CC[C@@](C)(c1nnn(n1)C)O
|
|
557
|
Cc1c(nn2cc(nc2n1)c3ccccc3)C
|
|
558
|
Cc1nc(on1)c2c(non2)N
|
|
559
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
560
|
C1=C[C@@H]2[C@H]3[C@H]([C@H]1O2)C(C3(F)F)(F)F
|
|
561
|
Cc1c(cn(n1)C)n2cnnn2
|
|
562
|
c1cc2c(c(c1)F)c(no2)N
|
|
563
|
CC1=C([C@@H](C1)C(=O)N)C(=O)N
|
|
564
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
565
|
COc1ccc-2c(c1)CCc3c2onc3
|
|
566
|
Cc1nn2cc(nc2s1)Cl
|
|
567
|
CCSc1ccc(nn1)N
|
|
568
|
c1cc(oc1)c2cc3nc4c(c(n3n2)[O-])SCC4
|
|
569
|
C1C2CC3CC1CC(C2)(C3)c4nsc(=O)o4
|
|
570
|
Cc1c[nH]nc1C(F)(F)F
|
|
571
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
572
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
573
|
c1ccc(cc1)c2ccc(=O)on2
|
|
574
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
575
|
Cc1c(scn1)OC(=O)C
|
|
576
|
c1ccc-2c(c1)-c3c2nc4ccccc4n3
|
|
577
|
CC(C)(C)OC(=O)N[C@@H]1[C@@H]2N(C1=O)CCCO2
|
|
578
|
c1ccc2c(c1)c(=O)n3c(n2)ccc(=O)[nH]3
|
|
579
|
Cc1csc(n1)c2cn(c(=O)[nH]c2=O)C
|
|
580
|
Cc1c-2ccocc2oc1=O
|
|
581
|
c1c(c(cc(c1F)F)F)F
|
|
582
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
583
|
c1c(c(n[nH]1)n2cnnc2)N
|
|
584
|
C1C[C@@H]2C[C@H]1C[C@@]2(C#N)CL
|
|
585
|
COCc1cn(nn1)[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
586
|
Cn1c(=O)c(c(s1)Cl)C#N
|
|
587
|
Cn1cc(cn1)c2ccncn2
|
|
588
|
C#CCOc1ccc(cc1)F
|
|
589
|
Cn1cnc2c1ncc(c2)C#N
|
|
590
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
591
|
c1ccc(cc1)NCCn2cccc2
|
|
592
|
c1ccc(cc1)n2c3c(cn2)c(nnn3)[O-]
|
|
593
|
Cn1c2c(sc1=O)CCC2
|
|
594
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
595
|
Cc1c(c(n(n1)C)Cl)C#N
|
|
596
|
c1ccc(cc1)n2c3=CNc4ccccc4N=c3[nH]c2=O
|
|
597
|
CC(=O)Oc1ccc(nn1)[O-]
|
|
598
|
c1cc(c2c(c1)non2)CO
|
|
599
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
600
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
601
|
CC1CCC2C(C1)NNS2
|
|
602
|
c1ccc2c(c1)nn(n2)c3cc(n[nH]3)O
|
|
603
|
c1cc(n2c1c(ncn2)N)Br
|
|
604
|
CC1C(CC(NN1)C2CCCCC2)N(C)C3CCCCC3
|
|
605
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)[O-]
|
|
606
|
Cc1cccc(c1)NC2=NCCO2
|
|
607
|
C1CCC(C1)c2nnc(o2)N
|
|
608
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
609
|
Cc1nc2cccc3c2n1CCN3
|
|
610
|
C1CCC2C(C1)C-3CSCCC3N2
|
|
611
|
c1ccnc(c1)SCc2ccco2
|
|
612
|
c1c(cnc2c1COC(=O)N2)Br
|
|
613
|
C[C@@]1(C(OC(=O)N1n2cnnc2)(C)C)O
|
|
614
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
615
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
616
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
617
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
618
|
c1ccnc(c1)n[nH]/c2=NC(=O)C3CC3
|
|
619
|
c1ccc2c(c1)nc(o2)c3nc4ccccc4s3
|
|
620
|
CC1=Nc2cccc3c2c1ccc3
|
|
621
|
c1ccc(c(c1)c2cc[nH]n2)O
|
|
622
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
623
|
c1c(nn2c1OCCC2)CO
|
|
624
|
c1ccc(cc1)Cn2cnnn2
|
|
625
|
CC1NNC(O1)NC(=O)C2CCC(CC2)C#N
|
|
626
|
c1c(=O)cc(n2c1CCC2)O
|
|
627
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
628
|
CCn1c2c(nc1Cl)CCC2
|
|
629
|
Cc1cn2c(n1)sc(n2)NCC=C
|
|
630
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
631
|
CC1(Cc2c(cc3c(n2)Nc4ccccc4N=C3O)CO1)C
|
|
632
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
633
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
634
|
C1CCC(CC1)NC2CCC3N(C2=O)CCC3
|
|
635
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
636
|
c1ccc2c(c1)[nH]c(n2)Nn3cnnc3
|
|
637
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
638
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
639
|
c1ccc(cc1)c2cn(c(=O)o2)c3ccccc3
|
|
640
|
CCSc1ncnc(n1)N
|
|
641
|
Cc1nc-2n(n1)Cc3c2cccc3
|
|
642
|
c1ccc2c(c1)C(=O)c3c(cc4c(c3C2=O)NCCN4)O
|
|
643
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
644
|
Cn1c2c(cn1)nnn(c2=O)c3ccccc3
|
|
645
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
646
|
Cc1[nH]cc(n1)c2ccccc2
|
|
647
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
648
|
Cn1cccc1CNc2[n-]nnn2
|
|
649
|
C=CCOc1cccnc1N
|
|
650
|
Cc1nc2cc(ccc2o1)F
|
|
651
|
Cc1c(c2cnnc(n2n1)[O-])Br
|
|
652
|
Cc1c2cc(ccc2[nH]n1)F
|
|
653
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
654
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
655
|
C1CCC2C(C1)CC3N(C2=O)CCN3
|
|
656
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
657
|
CS(=O)(=O)NCCOc1ccccc1
|
|
658
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
659
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
660
|
Cc1cs/c(=NC23CC4CC(C2)CC(C4)C3)/o1
|
|
661
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
662
|
|
|
663
|
Cc1cc(=O)n2c(n1)CCC2
|
|
664
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
665
|
Cc1ccc(cc1)c2cnon2
|
|
666
|
c12c(nc(s1)Cl)sc(n2)Cl
|
|
667
|
CNC(=O)Nc1c2ccccc2nnn1
|
|
668
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
669
|
c1[nH]c(=O)c2c(n1)c(c3n2CCCC3)C#N
|
|
670
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
671
|
Cc1nnc(c2n1c3ccoc3c2)[O-]
|
|
672
|
C1[C@@H]2C=C[C@H]1C([C@@]2(C(F)(F)F)F)(F)F
|
|
673
|
Cc1c(=O)nc([nH]n1)c2cccs2
|
|
674
|
Cc1cc2nc(cc(=O)n2o1)Cl
|
|
675
|
C1CC1C(=CC(=O)[O-])C2CC2
|
|
676
|
C[S@@](=O)c1ccc(nn1)n2cccc2
|
|
677
|
[H]/N=c/n(c(c(s1)C#N)N)c2ccccc2
|
|
678
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
679
|
Cn1c2cc([nH]c2nc1SC)C(=O)OC
|
|
680
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
681
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
682
|
c1cc(cc(c1)OCc2cscn2)N
|
|
683
|
Cc1c2ccccc2c(=O)on1
|
|
684
|
CC1=CNC(=O)CC(C1)(C)C
|
|
685
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
686
|
c1cc2nccn2c(c1)Cl
|
|
687
|
c1c2cn[nH]c2cnc1Cl
|
|
688
|
CN1Cc2ccccc2NC1=O
|
|
689
|
C/N=C/N(C(=O)SS1)C
|
|
690
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
691
|
c1cc2c(c(c1N)N)non2
|
|
692
|
c1ccc(cc1)Cn2cncn2
|
|
693
|
c1c(c2ncnc(n2n1)[O-])C#N
|
|
694
|
Cc1c2c(nnn2[O-])n(n1)C
|
|
695
|
CN(C)C(=O)Nc1n[n-]nn1
|
|
696
|
CC(=O)OCc1ccccc1
|
|
697
|
Cc1ccc(cc1)C#Cc2ccco2
|
|
698
|
c1ccc2c(c1)[C@H]3C[C@@H]([C@@H]2N3)c4ccc(nc4)Cl
|
|
699
|
c1c2nnnn2c(cn1)Cl
|
|
700
|
c1ccc(cc1)NC(=O)c2[n-]ncn2
|
|
701
|
CC1=Nc2c(cccn2)NC(=O)C1
|
|
702
|
Cc1c2ccccc2nc(n1)C
|
|
703
|
CN1CCn2c1nc3c2cccc3
|
|
704
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
705
|
Cc1cc2n(n1)CCC(=O)N2
|
|
706
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
707
|
Cc1c2cccnc2sn1
|
|
708
|
C1CCC(CC1)C(F)(F)F
|
|
709
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
710
|
Cc1c(c2c3nnc(n3cnc2o1)C)C(=O)[O-]
|
|
711
|
c1cc2c(cc1Br)C=C2
|
|
712
|
C1[C@H]2[C@H]3CO[C@@H]([C@@H]1NC(=O)N2)O3
|
|
713
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
714
|
Cc1cc(=O)cc(o1)/C=C/c2ccnn2C
|
|
715
|
Cc1c(n2c(n1)CCCCC2)O
|
|
716
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
717
|
COC(=O)c1c2c(n3cnnc3n1)OCC2
|
|
718
|
CNC=CN/C1=CC(=O)c2ccccc2
|
|
719
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
720
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
721
|
c1ccc(cc1)CCc2cnccn2
|
|
722
|
c1ccc2c(c1)c(cc(=O)[nH]2)N
|
|
723
|
C1CC([NH]C1)C(=O)OCC#N
|
|
724
|
CC1(CO/C(=C/C(=O)c2ccccc2)/N1)C
|
|
725
|
c1ccnc(c1)/C=C/c2ccco2
|
|
726
|
CSC1NNC(S1)C2CCCS2
|
|
727
|
c1ccc(cc1)CNc2cnccn2
|
|
728
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
729
|
CN1CCC(=O)N2C1=NCC2
|
|
730
|
CC(=O)OC1C2C3C2C4C3C41
|
|
731
|
|
|
732
|
Cn1cnc2c(c1=O)noc2C(=O)c3ccccc3
|
|
733
|
C1CC[C@H](NCC1)N/C=C/C2=CCCCC2
|
|
734
|
c1ccc(cc1)COn2ccnc2
|
|
735
|
C=CCc1cc2nccn2cn1
|
|
736
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
737
|
c1cc(cc(c1)n2c(c(n(c2=O)C3CC3)[O-])[O-])N
|
|
738
|
c1ccc(cc1)c2c3ccccc3nnn2
|
|
739
|
C[C@@]1(C(=Nc2ccccc2O1)O)C(=O)Nc3ccon3
|
|
740
|
Cc1c2c(nc(s2)C#N)n(n1)C
|
|
741
|
CN1CNC(=O)c2c1n[nH]n2
|
|
742
|
c1cncc2c1nc(o2)Cl
|
|
743
|
c1cn(cn1)C(=O)OCC#N
|
|
744
|
c1cc(oc1)c2nnc(s2)N
|
|
745
|
Cn1c(=O)n2cnc(c2nn1)C#N
|
|
746
|
Cc1c(=O)n2c(nn1)n(cn2)Cc3ccccc3
|
|
747
|
CCC[C@@H](C(F)(F)Cl)O
|
|
748
|
CNc1ccc(cc1F)C#N
|
|
749
|
c1ccc2c(c1)cccc2Cl
|
|
750
|
CC(C)C[C@@H](C(F)(F)F)N
|
|
751
|
CC1=Nc2ccccc2C1(C)C
|
|
752
|
c1ccc(cc1)NCc2cscn2
|
|
753
|
CNC1C2C(C3CCCCC3S2)NNN1
|
|
754
|
COC(=O)C#CC1=CCCCC1
|
|
755
|
C1C[C@H]2[C@@]34C[C@@H](N2C1)C=CC3=CC(=O)O4
|
|
756
|
CC1=CC(=O)N2CC3CC(CCC3N=C2N1)CL
|
|
757
|
C1CCC(CC1)c2[n-]nnn2
|
|
758
|
c1ccnc(c1)C#CC2=CCCC2
|
|
759
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
760
|
c1cc(cnc1)NCc2csnn2
|
|
761
|
C/C=C/c1c2c(on1)C[C@@H](OC2=O)C
|
|
762
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
763
|
Cc1nc2c(ncnc2o1)N
|
|
764
|
COC(=O)CCc1c[nH]cn1
|
|
765
|
c1ccc(cc1)C(=O)NCn2cncn2
|
|
766
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
767
|
CC(=O)c1ccc2nnnn2c1
|
|
768
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
769
|
Cc1c2c(onc2c(=O)[nH]n1)C
|
|
770
|
c1c(n2c(n1)CCC2)C(=O)[O-]
|
|
771
|
Cn1c(=O)c2c3c(c[nH]n3)oc2n(c1=O)C
|
|
772
|
COc1ccc2c(c1)non2
|
|
773
|
c1cc2c(cc1Cl)ncn3c2nn(c3=O)CC(=O)N
|
|
774
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
775
|
c1ccc(cc1)OCCn2ccnc2
|
|
776
|
Cc1c2ccccc2c(nn1)Sc3nccn3C
|
|
777
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
778
|
CCOC(=O)c1c(n(c(=O)s1)c2ccccc2)N
|
|
779
|
Cc1c2cc3c(nc2on1)C(=O)OCC3
|
|
780
|
COC1NC-2NCCC2C3N1CCO3
|
|
781
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
782
|
c1cc(oc1)c2cc(on2)N
|
|
783
|
Cc1nc2ccccc2c(=O)n1c3nc[nH]n3
|
|
784
|
c1cc(c2c(c1)ncs2)N
|
|
785
|
c1cc(oc1)/C=C/c2ccco2
|
|
786
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
787
|
C1CNNCC1CCC(=O)[O-]
|
|
788
|
CC(=O)C#C/C=C/c1ccccc1
|
|
789
|
c1cc(ccc1NC(=O)c2cc(=O)[nH+]c(s2)N)F
|
|
790
|
C1=CC2=CC(=O)O[C@@H]2[C@@H]([C@@H]1O)O
|
|
791
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
792
|
C1Cn2c(nnc2SC1)N
|
|
793
|
c1ccc2c(c1)OC(=Cc3ccco3)O2
|
|
794
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
795
|
C1=N[C@@H]2C(=N1)N=C(N=C2Cl)N
|
|
796
|
Cn1c(=O)cc([nH]1)c2ccccc2
|
|
797
|
c1cc(=O)oc2c1c3cc[nH]c3cc2
|
|
798
|
c1cc2c(nc1)[C@@H](O[C@@H]2O)O
|
|
799
|
C[C@@H]1Cc2c(cn[nH]2)C(=O)C1
|
|
800
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
801
|
c1cc2c(cc1F)CCNC2
|
|
802
|
CCc1c(nc(oc1=O)/C=C/c2ccccc2)[O-]
|
|
803
|
CC1=CO[C@@](CC1)(C)C(=O)[O-]
|
|
804
|
c1cc(oc1)c2nc([nH]n2)N
|
|
805
|
C1CO[C@@H](CO1)C(F)(F)F
|
|
806
|
c1cc2c3ccnn3nnc2cc1Cl
|
|
807
|
c1ccc(cc1)N2C(=CC2=O)O
|
|
808
|
COC(=O)[C@@H]1[C@H]2C=CO[C@@H]2O1
|
|
809
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
810
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
811
|
|
|
812
|
C(C(F)(F)I)(F)(F)F
|
|
813
|
C1CNC2=NC(=O)CCN2C1
|
|
814
|
COC(=O)C1=C(CCCC1)N
|
|
815
|
C1CC2C(CC1N)C=CCS2
|
|
816
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
817
|
CCOC1=CC(=O)N(C1)c2ccc(cc2)C
|
|
818
|
c1ccc(cc1)COc2c(non2)N
|
|
819
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
820
|
CC(=O)Nc1cc2c(oc1=O)CCC2=O
|
|
821
|
[H]/N=c/c(cnc2n1ccs2)C#N
|
|
822
|
c1cc(oc1)c2nc(on2)CO
|
|
823
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
824
|
C(CC(Cl)(Cl)Cl)C#N
|
|
825
|
CC1CCC(CC1)N=S=O
|
|
826
|
c1ccc2c(c1)CCC(=C2)n3ccnc3
|
|
827
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
828
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
829
|
COc1ccc2nnnn2n1
|
|
830
|
Cc1coc2n1cc(n2)c3ccc(cc3)Cl
|
|
831
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
832
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
833
|
C1CCC(C1)(C#N)NCCO
|
|
834
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
835
|
CSc1c2ccccc2nnn1
|
|
836
|
Cc1cc(no1)c2c(c(no2)C)CO
|
|
837
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
838
|
CCNc1nn2c(=O)cc(nc2s1)C
|
|
839
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2[nH]nc3
|
|
840
|
CC1=CC(=Nn2c(nnn2)N1)C
|
|
841
|
c1cnc2c(n1)c(cs2)N
|
|
842
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
843
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
844
|
c1cc2c(nc1)Nc3c(cccn3)O2
|
|
845
|
C1C=C[C@@H]2[C@@H]1[C@@H]3C[C@H]2[C@@H](C3)O
|
|
846
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
847
|
Cc1c2c(ncnc2on1)N
|
|
848
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
849
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
850
|
c1cc([nH]c1)C(=O)c2ccco2
|
|
851
|
CC(=O)c1cc(cnc1)OC
|
|
852
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
853
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
854
|
c1(c(sc(=O)s1)C(=O)N)C(=O)N
|
|
855
|
CC(=O)[C@@H](C1CCCCC1)O
|
|
856
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
857
|
Cn1cnn2c1nc(c2)c3ccccc3
|
|
858
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
859
|
c1c(c2c([nH]c1=O)CCC2)[O-]
|
|
860
|
c1c(c2c(s1)nns2)C#N
|
|
861
|
CCCCSc1nc(c2nc3ccccc3c(=O)n2n1)[O-]
|
|
862
|
CC1=CC(=O)Nc2c(cccn2)O1
|
|
863
|
c1ccn2cc(nc2c1)CC#N
|
|
864
|
C1CCc2c([nH]c(=O)[nH]2)CC1
|
|
865
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
866
|
Cc1nnc2n1N=C(CS2)C
|
|
867
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
868
|
c1cc(c(cc1Cl)c2cc([nH]n2)C(F)(F)F)O
|
|
869
|
c1c(cc(c2c1C=C(OC2)CO)O)O
|
|
870
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
871
|
c1cnccc1c2cnc3cc(nn3c2)O
|
|
872
|
COc1cc(=O)nc(o1)c2ccco2
|
|
873
|
C[C@@H]1C(=C)[C@]2(C(=O)O[C@@]1(C(=O)O2)C)CO
|
|
874
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
875
|
C1C2NC(=O)NC1NC(=O)N2
|
|
876
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
877
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
878
|
c1cc(sc1)CSc2ccc(cc2)O
|
|
879
|
CC1=Nc2c(ncn2N=C(C1)C)C#N
|
|
880
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
881
|
c1ccc(cc1)n2cc3cnnc(c3n2)[O-]
|
|
882
|
C1C[C@@H](C(=O)C1)C(F)(F)F
|
|
883
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
884
|
c1ccc2c(c1)c3ccc(cc3o2)n4ncnn4
|
|
885
|
c1ccc2c(c1)nn(n2)S(=O)(=O)N
|
|
886
|
CC(C)NC(=O)N[C@H]1COCCO1
|
|
887
|
Cc1cc(cc(c1)NC(=O)c2c(nco2)C)C
|
|
888
|
Cc1ccc(n1NC(=O)C)C
|
|
889
|
|
|
890
|
CN(C)c1nnnn1c2ncccn2
|
|
891
|
c1cnc(cn1)Br
|
|
892
|
c1cnc2c(n1)c(nnc2[O-])[O-]
|
|
893
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
894
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
895
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
896
|
C1C[C@@]23CC=CC[C@]2(C1)NC3=O
|
|
897
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
898
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
899
|
C1C2C(CC3C1OCO3)N/C(=C/4C=CC=[NH+]4)/C=C2O
|
|
900
|
CC12CC3CC(C1)CC(C3)C2
|
|
901
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
902
|
c1ccc(cc1)CNc2c(non2)O
|
|
903
|
C#C[C@@]1(CC[C@H]2CO[C@@H]1O2)O
|
|
904
|
Cc1nc(c(o1)N(C)C)C#N
|
|
905
|
c1(c(non1)N)c2nnc(o2)N
|
|
906
|
c1ccc(cc1)CNc2cnoc2
|
|
907
|
Cc1ccc(cc1)Nc2nc(=[NH2+])ss2
|
|
908
|
COC(=O)c1cc2c(s1)c(n[nH]2)N
|
|
909
|
COC(=O)[C@]12C(=NC=N1)C=NC=N2
|
|
910
|
CC(=O)Nn1cnc2c1cccc2
|
|
911
|
CC1(O[C@@H]2COC(=O)[C@@H]2O1)C
|
|
912
|
c1cc(nc2c1NC(=O)C2)F
|
|
913
|
C[C@@H]1[C@@H]([C@H]([C@@H](C(=N1)CO)O)O)O
|
|
914
|
CCc1cnnn1c2c(non2)N
|
|
915
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
916
|
c1ccc2c(c1)nn(n2)CC#N
|
|
917
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
918
|
c1ccc-2c(c1)CCc3c2nns3
|
|
919
|
c1ccc(cc1)n2cc3c(n2)Nc4ccccc4O3
|
|
920
|
COC(=O)CC1=Nc2nncn2C1=O
|
|
921
|
Cc1cc(c(nn1)C)SC
|
|
922
|
Cc1ccc2c(c1)SCC2
|
|
923
|
c1ccc(cc1)CCOn2ccnc2
|
|
924
|
c1ccc2c(c1)c(ns2)[O-]
|
|
925
|
|
|
926
|
CN1NC(NN1)C2[N-]NNN2
|
|
927
|
CC(C)(C)C(=O)n1ccnc1
|
|
928
|
c1ccc2c(c1)nc3c(n2)Sc4nncn4N3
|
|
929
|
c1cc(oc1)c2nccs2
|
|
930
|
C1CCC(C(C1)C2=C/C(=C/3C=CC=CC3=O)/C=NN2)O
|
|
931
|
Cc1cc(=O)n2c(n1)SCC(=N2)N
|
|
932
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
933
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
934
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
935
|
Cc1c(=O)n2c(nn1)SCC(=O)N2
|
|
936
|
c1ccc(cc1)SCn2cncn2
|
|
937
|
|
|
938
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
939
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
940
|
CC1=CC(=O)O[C@@H]1CC(=O)[O-]
|
|
941
|
c1cc(nn2c1nnn2)n3ccnc3
|
|
942
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
943
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
944
|
c1ccc2c(c1)cc([nH]2)c3nn4cnnc4s3
|
|
945
|
COCSc1ccccc1
|
|
946
|
c1ccc2c(c1)c3c(con3)c(=O)o2
|
|
947
|
CC1(O[C@@H]2CCC(=O)[C@@H]2O1)C
|
|
948
|
Cn1cc(cn1)c2nnc(o2)SC
|
|
949
|
c1cnn(c1)Cc2nnc3n2CCC3
|
|
950
|
C1CCC(CC1)/C=C/N2CCNC2
|
|
951
|
c1ccc(cc1)N2CCOC2=O
|
|
952
|
CCC(=O)Cc1cnccn1
|
|
953
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
954
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
955
|
Cc1cc(no1)CSc2ccccn2
|
|
956
|
Cc1cc2c(nc1Cl)OCCC2
|
|
957
|
c1c[nH]c2c1cc3c(c2)OCO3
|
|
958
|
C(#N)c1c(c2c(nc1N)non2)N
|
|
959
|
Cc1nc(co1)C#Cc2cccnc2
|
|
960
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
961
|
C1C[C@@H]2[C@@H](C2(Cl)Cl)OC1
|
|
962
|
C1C=C[C@@H]([C@@H]2N1C(=O)OC2)O
|
|
963
|
C1CCC(CC1)NC2=NC3C(CCCC3C(=O)[O-])C2=O
|
|
964
|
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
|
|
965
|
CCOC(=O)[C@@H]1CCCN=C1
|
|
966
|
C1C(=O)N[C@@H]2C=CC=CN2C1=O
|
|
967
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
968
|
CC1=CC[C@@H]2C[C@H]1OC2(C)C
|
|
969
|
Cc1nc2n(n1)C(=O)C(=N2)[O-]
|
|
970
|
c1c2n(nc1C(=O)[O-])CCOC2
|
|
971
|
C1c2nnnn2Cc3n1nnn3
|
|
972
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
973
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
974
|
c1cnc(cn1)I
|
|
975
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
976
|
COC(=O)C1=C(CC1)C(=O)OC
|
|
977
|
|
|
978
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
979
|
CC1C2C(NCN1)S[C@@H](CC2)O
|
|
980
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
981
|
C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2[C@H]4CO[C@@H](C3=O)O4
|
|
982
|
C(C(F)(F)S(=O)(=O)[O-])(F)F
|
|
983
|
Cc1csc(n1)c2cn[nH]c2N
|
|
984
|
Cc1cc(oc1)c2ccccc2
|
|
985
|
Cc1cc2n(n1)C(=O)CC(=O)C2
|
|
986
|
c1ccc(cc1)CCc2csnn2
|
|
987
|
c1cnn(c1)CC(F)(F)F
|
|
988
|
CN1CCn2ccc3c2c1nc(=O)[nH]3
|
|
989
|
c1cc(sc1)c2c(non2)N
|
|
990
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
991
|
Cc1nc(c2cccn2n1)Cl
|
|
992
|
[H]/N=c/n(ccs1)CC(=O)[O-]
|
|
993
|
C1CCC(CC1)C(=O)NN2CCNN2
|
|
994
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
995
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
996
|
CCOC(=O)N1CCC=CC1
|
|
997
|
c1c[nH]nc1C2CCCCC2
|
|
998
|
c1c(c(cnc1Cl)Cl)[O-]
|
|
999
|
CC(C)Oc1cc(on1)C#N
|
|
1000
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
Mouse click action: | Basic controls: | |||||||
---|---|---|---|---|---|---|---|---|
Left-Click to rotate Shift-Left-Click up & down to zoom Right-Click for Jmol's context menu | ||||||||
Jmol: an open-source Java viewer for chemical structures in 3D.http://www.jmol.org/ | ||||||||