(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
2
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
3
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
4
|
CC1CC2CC3CCCNN3C2NN1
|
|
5
|
c1ccc2c(c1)[C@@H](OC2=O)Nn3cnnc3
|
|
6
|
C1=CC2=NNC(=O)[C@@H]2C=C1C(=O)[O-]
|
|
7
|
c1ccc2c(c1)n3c(c(nn3)C(=O)N)sc4n2nnc4C(=O)[O-]
|
|
8
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
9
|
c1ccc-2c(c1)-c3cccc4c3c2cnc4
|
|
10
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
11
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
12
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
13
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
14
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
15
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
16
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
17
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
18
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
19
|
Cc1cc2c(n[nH]c(=O)c2c(=O)[nH]1)Cc3ccco3
|
|
20
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
21
|
c1ccc(cc1)c2nccn2c3ccnc(n3)Nc4ccccn4
|
|
22
|
|
|
23
|
c1ccc2c(c1)cnn(c2=O)Cc3ccon3
|
|
24
|
CNC(=O)c1c(n(nn1)C)Sc2c(nns2)C(=O)NC
|
|
25
|
c1ccc(cc1)c2c3ccccc3nnn2
|
|
26
|
COC(=O)c1cccc2c1c([nH]n2)Br
|
|
27
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
28
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
29
|
CNC1CNC2CCCCC2N1
|
|
30
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
31
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
32
|
CCn1cncc1c2nnc3n2cccc3Cl
|
|
33
|
CSc1nnc(s1)CN2CCSc3c2cccc3
|
|
34
|
c1ccc2c(c1)c(nnn2)Nc3ccccc3Cl
|
|
35
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
36
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
37
|
c1ccc2c(c1)[C@@H](C(=O)N2)[C@@H]3C(=O)Nc4ccccc4S3
|
|
38
|
Cc1c2cc(ccc2[nH]n1)F
|
|
39
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
40
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
41
|
Cc1c2nc3ccccc3n2c(=O)[nH]n1
|
|
42
|
c1c2c3c(c(=O)ncn3CC2)c(n1)Cl
|
|
43
|
c1cc(ccc1[C@@H](c2c(nc3nnc(n3n2)N)[O-])C(=O)[O-])Cl
|
|
44
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
45
|
CN1C=NC2C(NCN2[C@@H]3CC[C@@H](O3)CO)[C@@H]1O
|
|
46
|
Cc1nnc(s1)Sc2cc(=O)oc3c2cccc3
|
|
47
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
48
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
49
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
50
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
51
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
52
|
c1ccc(cc1)n2c(nnn2)n3c4ccccc4nn3
|
|
53
|
Cc1ccc(cc1)n2c(nnn2)c3nc4ccccc4s3
|
|
54
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
55
|
c1ccc2c(c1)ncn2c3c(nc4nccn4n3)C(F)(F)F
|
|
56
|
C[C@@H](c1cccc(c1)F)Oc2cccc3n2c(nn3)c4c[nH]cn4
|
|
57
|
CN(C)c1nnnn1c2ncccn2
|
|
58
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
59
|
CNc1cnnc2c1cccc2
|
|
60
|
CCOC(=O)C1=C([C@@H]2C=C(C=C[C@@H]2N=C1)C)OCC#N
|
|
61
|
|
|
62
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
63
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
64
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
65
|
CCOC(=O)[C@@H]1C=COc2n1c(cn2)Br
|
|
66
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
67
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
68
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
69
|
|
|
70
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
71
|
|
|
72
|
Cn1c2ccccc2n(c(=O)c1=O)Cc3ccon3
|
|
73
|
c1cnccc1CSc2nncs2
|
|
74
|
CS(=O)(=O)c1ccc2c(c1CCC(=O)[O-])O2
|
|
75
|
|
|
76
|
CCNC(=O)Oc1c2ccccc2on1
|
|
77
|
Cc1cnc(nc1c2ncnn2C)N
|
|
78
|
[H]/N=c/1[nH]nc2c(n1)-c3ccccc3C2=O
|
|
79
|
c1ccc-2c(c1)CCc3c2cn[nH]3
|
|
80
|
Cc1c2cc3c(nc2on1)C(=O)OCC3
|
|
81
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
82
|
c1ccc-2c(c1)CCc3c2nns3
|
|
83
|
c1cc2c(c(c1)F)ncnc2n3ccnc3
|
|
84
|
CCOC(=O)c1c(n(c2c1-c3c(non3)CC2)OC)C
|
|
85
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
86
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
87
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
88
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
89
|
CC(=O)N[C@@H]1CCC/C(=C/C2CCNC3C2CC(CC3)OC)/C1
|
|
90
|
C[C@@]1(CC[C@@](C(=C)n2c3c1cccc3nn2)(C)O)O
|
|
91
|
CC1=C([C@@]2(c3ccccc3-c4c2nc(o4)N)C(=O)N1)C(=O)OC
|
|
92
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
93
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
94
|
c1cc2c([nH]nc2Cl)nc1
|
|
95
|
c1cc(oc1)c2csc3c2c(=O)[nH]cn3
|
|
96
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
97
|
c1ccc2c(c1)c(ccn2)c3cocn3
|
|
98
|
c1ccc2c(c1)N3CCCN2c4c3cc(nn4)Cl
|
|
99
|
CC(=O)OC1C2C(C(NN1)[O-])SCCS2
|
|
100
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
101
|
Cc1c2c(cc(c(=O)o2)NC(=O)C)c(cn1)CO
|
|
102
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
103
|
c1ccc2c(c1)N(CCO2)C(=O)n3ccnc3
|
|
104
|
c1c2cc(nc(c2c(nc1O)O)O)O
|
|
105
|
c1csc2c1ncnc2n3ccnc3
|
|
106
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
107
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
108
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
109
|
c1cc2c(c(c1)S(=O)(=O)[O-])nn[nH]2
|
|
110
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
111
|
c1ccc(cc1)c2c(non2)/N=c/3c(nss3)Cl
|
|
112
|
C1Cc2c(nc(nc2c3c4c(nc(n3)N)CCC4)N)C1
|
|
113
|
c1c[nH]c2c1c(cnc2)Cl
|
|
114
|
Cc1c(cccn1)c2cc3cccnc3n2CCC(=O)[O-]
|
|
115
|
c1c(snn1)N2CCOCC2
|
|
116
|
Cc1nc(c2n1ccnc2Cl)[C@@H]3CCOC3
|
|
117
|
Cccccn(/c1=[NH+]C(=O)c2ccco2)C(=O)c3ccco3
|
|
118
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
119
|
Cc1c(c(on1)C)Cn2ccccc2=O
|
|
120
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
121
|
c1ccc2c(c1)c-3c4c(nc(=[NH2+])c3c(o2)O)CCCCC4
|
|
122
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
123
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
124
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
125
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
126
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
127
|
COC(=O)c1cccc2n1ncn2
|
|
128
|
CC1=Nc2cccc3c2c1ccc3
|
|
129
|
C[C@@H]1Cn2c(cc3c2c(ccc3)O1)C(=O)[O-]
|
|
130
|
CC(=O)c1cc2cnccc2[nH]c1=O
|
|
131
|
c1ccc2c(c1)c(ncn2)N3CCNc4c3cccc4
|
|
132
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
133
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
134
|
c1csc2c1n3cn[nH]c(=O)c3c2
|
|
135
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
136
|
Cc1c-2c(on1)CCc3c2n(nc3C(=O)[O-])C
|
|
137
|
|
|
138
|
CCOC(=O)c1c-2c(c(=O)oc1N)C(=O)c3c2cccc3
|
|
139
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
140
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
141
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
142
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
143
|
CCOC1C-2C(NC(N1)N)CCC3C2CCCC3
|
|
144
|
C1Cc2c3c(nnc4c3c(nn2)CCC4)C1
|
|
145
|
c1ccc(cc1)Cn2c(nnc2Cl)C3CC3
|
|
146
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
147
|
COC1=CC2CCNC3C2C(C4CCCCC4C3[O-])C1=O
|
|
148
|
Cc1nc(no1)CSc2ccccc2
|
|
149
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
150
|
c1c2cc(oc2ncc1F)CO
|
|
151
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
152
|
c1ccc(cc1)n2cnc3c2cncn3
|
|
153
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
154
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
155
|
[H]/N=c/n(c2c(s1)CCCC2)CC(=O)c3ccccc3
|
|
156
|
Cc1nnc(c2n1c3ccoc3c2)[O-]
|
|
157
|
c1ccc2c(c1)CC(=O)NC=C2
|
|
158
|
Cc1cc(no1)c2nnnn2c3ccc(cc3)F
|
|
159
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
160
|
CCOC(=O)c1cnn2c1nnn(c2=O)c3ccccc3
|
|
161
|
CCc1c(c(on1)C)c2nn3c(nnc3s2)C
|
|
162
|
c1ccc2c(c1)C(=O)OC2(n3cnnn3)n4cnnn4
|
|
163
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
164
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
165
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
166
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
167
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
168
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
169
|
CCOC(=O)/C=C/CCCc2c1cco2
|
|
170
|
c1ccc2c(c1)ncn2c3c(nns3)C(=O)N
|
|
171
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
172
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
173
|
c1ccc2c(c1)-n3cnnc3CCS2
|
|
174
|
c1ccc(cc1)S(=O)(=O)c2cc(c(=O)n3c2CCC3)O
|
|
175
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
176
|
c1ccc2c(c1)nnn2CN3CSc4c3cccc4
|
|
177
|
c1ccc2c(c1)c(=O)n3n2C[C@@H](C3)O
|
|
178
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
179
|
c1csc2c1c(n[nH]c2=O)N
|
|
180
|
c1cc(n2c1c(ncn2)N)Br
|
|
181
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
182
|
CO[C@@]1(CC(=O)N1c2ccccc2)n3c4ccccc4nn3
|
|
183
|
CCOC(=O)c1cccnn1
|
|
184
|
Cc1cc(=O)n2n1c3ccccc3nn2
|
|
185
|
CCCn1c2=N[C@@H](C(=c2c(=O)[nH]c1=O)[O-])C
|
|
186
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
187
|
Cn1cc(nc1)S(=O)(=O)Oc2ccsc2C(=O)OC
|
|
188
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
189
|
c1ccc(cc1)n2c(nnc2[O-])c3cccnc3
|
|
190
|
CCc1c(nnc(c1C#N)[O-])CC
|
|
191
|
CC1CCC2C3C1C(=O)[C@@H](C3=CCN2C(=O)C)C(=O)N
|
|
192
|
CC1(Cc2ccccc2-c3n1nnn3)C
|
|
193
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
194
|
c1cc2cccc3c2c(c1)C(=O)O3
|
|
195
|
Cc1c(c2c(=O)[nH]cnc2s1)S(=O)(=O)N3CCCCC3
|
|
196
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
197
|
CNc1c2c(c3c(n1)sc(n3)NC)n(cn2)C
|
|
198
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
199
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
200
|
CC(=O)c1n[nH]c2n1ncc2
|
|
201
|
c1ccc2c(c1)c(sn2)N3CCCCCC3
|
|
202
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
203
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
204
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
205
|
CC(=O)Nc1c2c(cs1)c(c(nc2SC)O)C#N
|
|
206
|
Cc1ncc2c(n1)-c3cc(ccc3SC2)F
|
|
207
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
208
|
c1c2c(nc(n1)N)SCC2
|
|
209
|
C1CCC(CC1)n2c3c([nH]c(=O)c2=O)CCC3
|
|
210
|
Cn1c(nnn1)Sc2cccc(c2C#N)F
|
|
211
|
Cc1c(cnc2c1c3cc(ccc3o2)O)C(=O)C
|
|
212
|
Cc1c2c(c3ccccc3n1)-n4cnnc4SC2
|
|
213
|
c1ccc2c(c1)ncc3n2ncc3
|
|
214
|
Cc1c(=O)n2ccccc2nn1
|
|
215
|
Cc1cc(no1)CSc2nncs2
|
|
216
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
217
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
218
|
CC(=O)n1c(c(nn1)CC#N)c2ccccc2
|
|
219
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
220
|
CC1(C=Cc2c(c3ccccc3[nH]c2=O)O1)C
|
|
221
|
c1ccc2c(c1)-c3ccccc3N=CN2
|
|
222
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
223
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
224
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
225
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
226
|
CC(=O)Nc1c2c(cs1)c3ccccc3oc2=O
|
|
227
|
CN(Cc1nnc(s1)SC)c2ccccc2F
|
|
228
|
c1nc(c2n1CC(=O)NC2)C(=O)N
|
|
229
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
230
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
231
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
232
|
C[C@@H]1CC=CCN(C1)S(=O)(=O)c2ccccn2
|
|
233
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
234
|
Cn1c2c(cn1)c(ncn2)n3cnc4c3cccc4
|
|
235
|
C1CCC(C(C1)C2CCCCC2C3=NC3)C4=NC4
|
|
236
|
c1cnc(c(n1)C#N)n2ccnc2
|
|
237
|
Cc1ccc(nc1)n2cnnn2
|
|
238
|
c1ccc-2c(c1)CNC(=O)c3c2cccc3
|
|
239
|
c1ccc(cc1)c2c3ccccc3[nH]c(=O)c2Sc4[nH]cnn4
|
|
240
|
CC1C2C(C(C3N2N(N1)CC3)C(=O)OC)C(=O)OC
|
|
241
|
CC1=C([C@@H](N2C(=N1)NC=N2)c3ccccn3)C(=O)N
|
|
242
|
Cc1c(c(n[nH]1)O)[C@@H](c2ccco2)C(C#N)C#N
|
|
243
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
244
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
245
|
CNC1C2C(C3CCCCC3S2)NNN1
|
|
246
|
|
|
247
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
248
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
249
|
c1ccc2c(c1)-c3nncn3-c4ccccc4S2
|
|
250
|
c1ccc2c(c1)n3cnnc3s2
|
|
251
|
CC1(c2ccc(cc2[C@H]([C@@H]1O)n3ccccc3=O)N)C
|
|
252
|
Cc1ccc(n1c2c(ccs2)c3cc([nH]n3)N)C
|
|
253
|
C1CCn2c(nnn2)[C@@H](C1)C(=O)[O-]
|
|
254
|
Cc1ccc(n1c2cnccn2)C
|
|
255
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
256
|
CN1CC[C@@H](c2c1cccc2)n3c4ccccc4nn3
|
|
257
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
258
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
259
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
260
|
Cn1cc(c(n1)c2ccncc2)c3ccc4c(c3)C(=O)NC4
|
|
261
|
CC(=O)N[C@@H]1[C@@H](S(=O)(=O)NC1=O)C2CCCCC2
|
|
262
|
c1c2c(cnc1Cl)CCN2
|
|
263
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
264
|
C1=C([NH2+]c2nnc(n2N=C1C(F)(F)F)N)[O-]
|
|
265
|
C1CCC2C(C1)CC[C@@H]3N2[C@@H]4C5CCCCC5C(=O)N4CC3
|
|
266
|
CCCS(=O)(=O)N1CCC[C@@H]1c2c(noc2CC)C
|
|
267
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
268
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
269
|
Cc1c(c2cnnc(n2n1)[O-])Br
|
|
270
|
CCOC(=O)c1c2nc([nH]n2cn1)C(=O)C
|
|
271
|
c1cc(c2c(c1)non2)CO
|
|
272
|
c1ccc2c(c1)c(=O)n(cn2)Cc3c(snn3)Cl
|
|
273
|
CC1C(C(ON1)C)C2=CCCCC3C2CCCC3
|
|
274
|
Cc1cc(=O)oc2c1c(nc(n2)C)[O-]
|
|
275
|
c1ccc2c(c1)CCCN2c3c(cno3)C#N
|
|
276
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
277
|
Cc1c2c(c3ccccc3[nH]2)c4c([o+]1)CCCC4=O
|
|
278
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
279
|
Cc1ccc(cc1)n2cnnn2
|
|
280
|
CCOC(=O)C1=C(Sc2ccccc2C1)NC(=O)C
|
|
281
|
CCOC(=O)c1c2n(cn1)-c3ccc(cc3C(=O)N(C2)C)F
|
|
282
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
283
|
c1ccc2c(c1)nnn2CC#C[C@@H](c3ccco3)O
|
|
284
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
285
|
CC1(c2c([nH]c(=O)s2)Sc3c1sc(n3)[O-])C
|
|
286
|
c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
|
|
287
|
Cc1c(c-2c(cn1)CCc3c2cccc3)C#N
|
|
288
|
Cc1c(c(on1)C)n2c(c(nn2)C(=O)C)C
|
|
289
|
c1c2n(c(=O)[nH]c1=O)[C@@H]3[C@@H]([C@@H]([C@H]([C@@H]2CCO)O3)O)O
|
|
290
|
Cc1c2c(onc2c(=O)[nH]n1)C
|
|
291
|
C1Cc2c(onc2c3c4c(on3)CCC4)C1
|
|
292
|
Cc1c2c([nH]n1)NC3=C([C@@H]2C)C(=O)OC3
|
|
293
|
c1ccc(cc1)CNc2c(non2)O
|
|
294
|
Cc1c2c(c3ccccc3n1)SCC2
|
|
295
|
Cc1c(c([nH]n1)N)[C@@](c2nccn2C)(C(F)(F)F)O
|
|
296
|
c1cc2c(c(c1)F)c(no2)N
|
|
297
|
c1cc2c(cc1I)C3=C(C2)C(=O)NCC3
|
|
298
|
c1ccc2c(c1)-c3cccnc3C2=O
|
|
299
|
|
|
300
|
c1ccc2c(c1)[N-]C3=NC(=O)C(=O)N23
|
|
301
|
C1CN2C=Nc3c(c(no3)C(=O)[O-])C2=N1
|
|
302
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
303
|
c1ccc2c(c1)ccc(c2C3=c4ccccc4=CC[C@@]3(N)O)O
|
|
304
|
Cc1cc(c2nncn2n1)n3cc(c(=O)[nH]c3=O)F
|
|
305
|
CN(C)c1c2c(ncn1)Sc3c(c(ncn3)OC)C=N2
|
|
306
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
307
|
C[C@@H]1Cc2c(cn[nH]2)C(=O)C1
|
|
308
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
309
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
310
|
c1cnccc1[C@@H]2CCC=CC2
|
|
311
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
312
|
CCOC(=O)c1c2n(cn1)C(OC2=O)(C)C
|
|
313
|
c1ccc(cc1)CCn2cnnn2
|
|
314
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
315
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
316
|
|
|
317
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
318
|
Cc1c2c(on1)CCOC(=O)N2
|
|
319
|
|
|
320
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
321
|
CCOC(=O)C1=C(NC(=O)N[C@@H]1C)c2cccs2
|
|
322
|
c1ccc2c(c1)ncn2C3=NCCN3
|
|
323
|
Cn1ccc(n1)C(=O)n2cccn2
|
|
324
|
Cc1[nH]c(c(n1)[C@@H](c2ccc(cc2)F)C(C#N)C#N)[O-]
|
|
325
|
C1CCc2c(nc(nn2)N)C1
|
|
326
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
327
|
Cn1c(ccn1)c2nnc(n2C)SC
|
|
328
|
Cc1nnnn1C2CCCCC2
|
|
329
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
330
|
CC1CC2CC(OC2C3C1C(NNC3CL)CL)C
|
|
331
|
c1ccc2c(c1)nc3c(n2)nc[n-]3
|
|
332
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
333
|
c1ccc2c(c1)CS(=O)(=O)N=C2N
|
|
334
|
CN1c2ccc(cc2-c3n[nH]c(=O)c(=O)n3CC1=O)Cl
|
|
335
|
c1ccc2c(c1)nnn2CCS(=O)(=O)N3CCCC3
|
|
336
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
337
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
338
|
C1CC[C@@]2(C(=CC(=O)O2)C1)N3CCOCC3
|
|
339
|
c1cc2c(nc1)onc2Cl
|
|
340
|
C1CCc2c([nH]nc2O)CC1
|
|
341
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
342
|
c1ccc(cc1)c2cc3nnc(c(n3n2)c4ccco4)C#N
|
|
343
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
344
|
Cc1nc(on1)CN2CCSc3c2cccc3
|
|
345
|
Cc1c2c(oc(c2c(=O)n(n1)CC(=O)[O-])n3cccc3)C
|
|
346
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
347
|
Cc1c(cnc(c1C#N)N)Cc2cc(ccc2OC)OC
|
|
348
|
c1cc(ccc1[C@@H]2[N-]S(=O)(=O)N=C3N2CCC3)F
|
|
349
|
Cn1c(nnc1SC)Cn2c3ccccc3sc2=O
|
|
350
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
351
|
CC1CC(N(N1)C(=O)C2CNN3C2N(CCC3=O)C(C)C)C
|
|
352
|
CN1c2cnc(nc2-c3c(ccs3)S1(=O)=O)N
|
|
353
|
c1nncn1N2C3=CCCCC3=C(C2=O)O
|
|
354
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
355
|
C1CCn2c(nnc2CC#N)C1
|
|
356
|
Cc1nc2c3c(ncn2n1)OC4=NN=C([C@H]4[C@H]3c5ccccc5)C
|
|
357
|
c1ccc(cc1)n2c(nnn2)Sc3nc4ccccc4o3
|
|
358
|
Cn1cnnc1Cc2ccccc2
|
|
359
|
CC[C@@]1(C2CCCN2-C3CCCCC3C(=N1)C4CCCCC4)O
|
|
360
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
361
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
362
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
363
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
364
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
365
|
c1cnc2c(n1)c(cs2)N
|
|
366
|
CC(=O)c1cc2c(cco2)nc1
|
|
367
|
Cn1c(=O)c2ccccc2nn1
|
|
368
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
369
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
370
|
c1ccc2c(c1)C=Nc3ccccc3O2
|
|
371
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
372
|
Cc1c2cnnc(c2c(n1C)C)Sc3ccc(cc3)Cl
|
|
373
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
374
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
375
|
Cc1c2c([nH]n1)OC(=C([C@@H]2c3ccco3)C(=O)N)N
|
|
376
|
c1c2c(nc(n1)N)CCCC2=O
|
|
377
|
CC1=C[C@@]23C=CC=CC2=CN=C3C=C1
|
|
378
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
379
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
380
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
381
|
Cn1ccc(n1)c2cc(nc3n2c4ccccc4n3)[O-]
|
|
382
|
c1cc(oc1)CNn2cnnc2
|
|
383
|
c1cc2c(c3c1nncc3)non2
|
|
384
|
c1ccc(c(c1)C(=O)[O-])Sc2c(nccn2)Cl
|
|
385
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
386
|
C1CCC2C(C1)CC3=NC(=O)N=C23
|
|
387
|
C[C@@H]1C=CN(c2n1ncc2C(=O)[O-])C
|
|
388
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
389
|
Cc1csc(=O)n1CC(=O)ncccc/c2=NC(C)C
|
|
390
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
391
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
|
392
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
393
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
394
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
395
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
396
|
Cc1c(non1)[C@@H]2CCCN2C(=O)c3ccnc(c3)NC
|
|
397
|
c1c2c(n3c(n1)ncn3)CCC2
|
|
398
|
Cc1cc(no1)n2c(c[nH]c2=O)C
|
|
399
|
C1=C[C@@]2([C@@H]3[C@@H]([C@H]1O2)C(=NC3=O)[O-])CO
|
|
400
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
401
|
c1cnn2c1N[C@H](CC2=O)CO
|
|
402
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
403
|
Cc1c(c(n(n1)C)c2c(nns2)C)C(=O)OC
|
|
404
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
405
|
CC1=NNC2=Nc3ccccc3[C@@H](N12)c4ccccc4
|
|
406
|
C1CCC(CC1)NC2=NC3C(CCCC3C(=O)[O-])C2=O
|
|
407
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
408
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
409
|
Cc1c2c([nH]n1)CCOC(=O)N2
|
|
410
|
|
|
411
|
[H]/N=c/n(c(co1)C)CC(=O)c2ccc(cc2)C
|
|
412
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
413
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
414
|
c1(c(sc(=O)s1)C(=O)N)C(=O)N
|
|
415
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
416
|
C[C@@H]1c2nnc(n2N[C@@H](O1)c3ccccc3Cl)[C@@H](C)O
|
|
417
|
c1ccc(cc1)S(=O)(=O)c2cscc2n3cccc3
|
|
418
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
419
|
COc1ccc-2c(c1)CCc3c2onc3
|
|
420
|
c1cc(oc1)C(=O)N[C@@H]2CC(=O)c3c2ccs3
|
|
421
|
c1cc(ccc1[C@@]2(NC(=O)N=C3N2C=CC=C3)C(F)(F)F)Cl
|
|
422
|
c1cc(c2c(c1)oc(=O)o2)C(F)(F)F
|
|
423
|
c1c2n(nn1)CCn3c(cnn3)S2
|
|
424
|
|
|
425
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
426
|
C1C[C@@H]2C[C@H]1[C@@H]3C2=Cc4c([nH]c(=O)s4)S3
|
|
427
|
CC1=C[C@@H](CC(=O)N1)c2ccco2
|
|
428
|
CO[C@@H]1C[C@@]23C(=CCN2CC[C@@H]4C3=CC(=O)OC4)C=C1
|
|
429
|
Cc1c(c(c2n1CCS2)C(=O)[O-])C(=O)[O-]
|
|
430
|
Cc1c2c(oc(c2c(nn1)C)C)C
|
|
431
|
Cc1nc-2n(n1)C=COc3c2cccc3
|
|
432
|
Cc1c(n2ccccc2n1)Sc3ccccc3
|
|
433
|
C1Cc2c(nnc(c2C(F)(F)F)[O-])C1
|
|
434
|
c1ccc2c(c1)C(=O)O[C@@]23Oc4cccnc4S3
|
|
435
|
c1ccc(cc1)C(=O)[C@H](C#N)C2=NCCC2
|
|
436
|
c1c(c(on1)N2CCOCC2)C#N
|
|
437
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
438
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
439
|
c1csc(c1n2cnnn2)C(=O)[O-]
|
|
440
|
c1ccc2c(c1)/C=CCCCC[C@H]2O
|
|
441
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
442
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
443
|
CN1CC(=Nc2ccccc2C1=O)Cl
|
|
444
|
C#Cc1cc2ccccc2nc1
|
|
445
|
Cc1ccc(s1)[C@@H]2CCCc3c2cccc3
|
|
446
|
CCOC(=O)C1=NCc2c1cccc2
|
|
447
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
448
|
c1ccc(cc1)n2c3c(nc2Cl)CCC3
|
|
449
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
450
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
451
|
C1CC2C3C(C(NNN3)[O-])SC2NC1
|
|
452
|
COC(=O)c1c(cc(=O)n2c1CCCCC2)[O-]
|
|
453
|
Cc1csc(n1)[C@@H](C#N)C2=NS(=O)(=O)c3c2cccc3
|
|
454
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
455
|
CSc1nnc(n1c2ccccc2)c3cc4c([nH]3)cco4
|
|
456
|
CC1([C@@H]2CC(=O)CCCN2C(=O)N1)C
|
|
457
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
458
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
459
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
460
|
CCCCN1C(=O)C[C@@H]2[C@@]1(OCC2)C
|
|
461
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
462
|
CCCC1C(=C(NC(=C1C(=O)N)C)C)C(=O)N
|
|
463
|
CCOC(=O)n1cccc(c1=[NH2+])C
|
|
464
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
465
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
466
|
Cc1c(c(n[nH]1)C)NC(=O)C
|
|
467
|
c1ccc(cc1)[C@@]2(C=C(C(=O)N2c3ccccc3)O)O
|
|
468
|
C1CCC(CC1)C2CCNN2S(=O)(=O)C3=CC=CCC=C3
|
|
469
|
|
|
470
|
C=CCc1cc2nccn2cn1
|
|
471
|
c1ccc2c(c1)CC=N[C@@H]2Cn3c4ccccc4nn3
|
|
472
|
C=CCNC(=O)Cn1c(cc2c1nccc2)[C@@H]3CCCO3
|
|
473
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
474
|
COc1ccc(c(c1)O)c2c(cn[nH]2)c3ccccc3OC
|
|
475
|
CCSc1ccc(nn1)N
|
|
476
|
Cc1nc(c2n1nc[nH]c2=O)CC(C)C
|
|
477
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
478
|
C1Cc2nnc(n2C1)C(=O)[O-]
|
|
479
|
C1CCC(CC1)C2=C3[C@@H](CC4C2CCCC4)CNC3=O
|
|
480
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
481
|
c1ccc(cc1)c2nnc(o2)Cn3c4ccccc4sc3=O
|
|
482
|
c1ccc(cc1)n2c(nnn2)n3ccnc3
|
|
483
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
484
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
485
|
CCOc1/c(=N/Cc2ccccc2)/c(=O)c1[O-]
|
|
486
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
487
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
488
|
c1cc2c(c(cs2)N)nc1
|
|
489
|
c1ccc(cc1)n2c3c(cn2)c(nnn3)[O-]
|
|
490
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
491
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
492
|
CN(CCO)c1cnccn1
|
|
493
|
Cc1cc(no1)c2nnc(o2)N
|
|
494
|
c1c2cn[nH]c2cnc1Cl
|
|
495
|
C[C@@]1(C(=O)N=C2N1C=CC=C2)CC(=O)[O-]
|
|
496
|
CNC(=O)Nc1ccc2c(c1)nnn2C
|
|
497
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
498
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
499
|
Cc1c(=O)n2c(csc2nn1)c3ccccc3
|
|
500
|
c1cc(oc(=O)c1)c2cccnc2
|
|
501
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
502
|
Cc1c2c(c(cn1)N)COC(O2)(C)C
|
|
503
|
CN1CCC2NNCN2C1=O
|
|
504
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
505
|
c1ccc(cc1)/C/2=N/CCOC(=O)c3c2cccc3
|
|
506
|
CC(=O)NCCc1coc2c1ccnc2
|
|
507
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
508
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
509
|
Cc1c2c(nc(n1)N)OCC2
|
|
510
|
c1ccc(cc1)c2c-3n(c(=O)s2)C(=O)c4c3cccc4
|
|
511
|
c1cc2cccc3c2c(c1)NS3(=O)=O
|
|
512
|
COC(=O)C1=C2C(=O)OCCN2C(=O)CC1
|
|
513
|
Cc1nc2cccc3c2n1CCN3
|
|
514
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
515
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
516
|
Cc1nc-2n(n1)Cc3c2cccc3
|
|
517
|
c1(=O)c(=O)sc2nnc(n2[nH]1)C(F)(F)F
|
|
518
|
c1ccc(cc1)n2c(nnn2)Cn3c(nnn3)C4CCCC4
|
|
519
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
520
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
521
|
Cc1c(cccn1)C2=NCCC2
|
|
522
|
CN1C=C[C@@H]2c3ccccc3[C@@H](C2=C1)c4ccccc4
|
|
523
|
C1CCC(C1)c2nnc(o2)N
|
|
524
|
c1ccc2c(c1)nnn2CF
|
|
525
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
526
|
COC(=O)[C@@H]1CCC(=O)c2n1ccc2
|
|
527
|
Cc1nc(co1)C#Cc2cccnc2
|
|
528
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
529
|
Cc1c(c(n[nH]1)O)n2c3ccccc3c(=O)c4c2cccc4
|
|
530
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
531
|
CCn1c2ccccc2n(c1=O)Cc3nnc(s3)SC
|
|
532
|
|
|
533
|
Cn1c2c(c(=O)[nH]c1=O)[C@H](CC(=O)N2)C(=O)[O-]
|
|
534
|
Cc1c2c(n[nH]1)C=C(C[C@@H]2c3ccco3)c4ccco4
|
|
535
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
536
|
c1cn(c(n1)CN(Cc2nnnn2C3CC3)C4CC4)C(F)F
|
|
537
|
c1cnn2c1ncc3c2C(=O)OCC3
|
|
538
|
CCOC(=O)Cn1c(noc1=O)Cc2ccccc2
|
|
539
|
c1ccc2c(c1)C(=O)c3nccn3C2=O
|
|
540
|
c1c2c(nc(n1)N)CCOC2
|
|
541
|
c1cc2c(nc1)S[C@@H]3c4cccnc4S[C@H]2O3
|
|
542
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
543
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
544
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
545
|
c1ccc2c(c1)N3C[C@H](CN=C3S2)O
|
|
546
|
c1cc2c(cc1N)N3CC[NH+]=C3S2
|
|
547
|
Cc1c2c(c(cn1)CO)COC(N2)(C)C
|
|
548
|
CC1C2C(NCN1)S[C@@H](CC2)O
|
|
549
|
C1CN2C(CN1)CNC2CL
|
|
550
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
551
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
552
|
Cc1nc(c(o1)n2cnc3c2cccc3)C#N
|
|
553
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
554
|
c1ccc2c(c1)N=CC=C(S2)c3cccnc3
|
|
555
|
C1C[C@@H](Cc2c1snn2)C(=O)[O-]
|
|
556
|
c1cnnc2c1-c3c(non3)CC2
|
|
557
|
Cc1csc2c1n3c(c(nn3)C#N)[nH]c2=O
|
|
558
|
C1CCC2C(C1)C-3CSCCC3N2
|
|
559
|
c1ccc2c(c1)[C@@H]3c4cccn4CCN3C2=O
|
|
560
|
c1ccc2c(c1)c3c(s2)C(=O)NCC3
|
|
561
|
Cc1ccc(n1c2ccc3c(c2)nns3)C
|
|
562
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
563
|
|
|
564
|
Cc1c2c(on1)CCCC2=O
|
|
565
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
566
|
c1ccc(cc1)COn2cc(cn2)I
|
|
567
|
c1csc2c1CCO[C@@H]2CC(=O)[O-]
|
|
568
|
Cc1cc(n(n1)C)C(=O)c2c(nn(c2Cl)C)C
|
|
569
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
570
|
c1cn2c(cc1=O)C(=O)NCC2
|
|
571
|
c1cc2c(csc2nc1)N3CCCC3
|
|
572
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
573
|
Cc1c(c(on1)C)S(=O)(=O)n2ccnc2
|
|
574
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
575
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
576
|
Cc1ccc2c(c1)nnc(n2)N
|
|
577
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
578
|
Cn1c(cnc1Cn2c3ccccc3ncc2=O)Cl
|
|
579
|
c1ccc2c(c1)nc(c3n2nnn3)N
|
|
580
|
C[C@@H]1c2nc(nn2[C@](C(=O)O1)(C)CC#C)[C@@H](C)O
|
|
581
|
|
|
582
|
Cc1c(c(no1)c2ccccc2)c3ccn[nH]3
|
|
583
|
C1CCC2C(C1)[C@@H]3CC[C@H]2NC3=O
|
|
584
|
c1csc2c1c(ncn2)N
|
|
585
|
c1ccc2c(c1)CCC3=C(C=C2)C(=O)OC3
|
|
586
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
587
|
Cc1nnc(o1)C(=O)c2c(c3ccccc3n(c2=O)C)OC(=O)C
|
|
588
|
Cc1coc(=O)n1c2ccc(c(c2)Cl)Cl
|
|
589
|
Cc1c(c-2c(cn1)COc3c2cccc3)C#N
|
|
590
|
c1c(c2ncnc(n2n1)[O-])C#N
|
|
591
|
c1ccc(cc1)CS(=O)(=O)n2cnc3c2[nH]c(=O)[nH]c3=O
|
|
592
|
CC1=CC(=O)Nc2ccccc2N1
|
|
593
|
c1cc(cnc1)c2cc(c3c(n2)nc(nc3[O-])N)C(F)(F)F
|
|
594
|
C1C#C/C=CC#CC[C@@H]([C@@H]1CO)CO
|
|
595
|
|
|
596
|
Cccccn(/c1=[NH+]C(=O)C2CC2)C(=O)C3CC3
|
|
597
|
C1CCc2c(c3c(s2)C(=O)NCC3)C1
|
|
598
|
c1ccc(c(c1)N)Sc2cc(nnc2Cl)Cl
|
|
599
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
600
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
601
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
602
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
603
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
604
|
c1ccc2c(c1)[nH]c(=O)n2c3nc4c(o3)cccn4
|
|
605
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
606
|
c1ccc2c(c1)C[C@@H]3CNCc4c3c(ccc4)S2
|
|
607
|
CSc1nccc(n1)c2cnoc2
|
|
608
|
Cc1cnnn1c2c(nn(c2C)C)C
|
|
609
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
610
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
611
|
c1ccc2c(c1)C[C@@H]2c3ccccn3
|
|
612
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
613
|
CS(=O)(=O)N1CN(c2c1cccc2)S(=O)(=O)C
|
|
614
|
C1CC2N3C1CCC4CCC(N4CC3)CC2
|
|
615
|
Cc1c(cco1)c2nnc(o2)N
|
|
616
|
Cc1c2cc(sc2n(n1)C)CO
|
|
617
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
618
|
c1cc2c(nc1)n(nn2)[O+]=C(N)N
|
|
619
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
620
|
Cc1ccc2nc(=O)on2c1
|
|
621
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
622
|
CC(=O)N1CCC=C1Cc2ccccc2
|
|
623
|
COc1ccccc1n2ccnc(c2=O)N
|
|
624
|
Cc1c(c(n[nH]1)C)[C@@H]2C[C@@H](C=C2)O
|
|
625
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
626
|
Cc1nnc2n1N(C(=C(S2)C)c3ccccc3)C(=O)C
|
|
627
|
CC(=O)NC[C@@H](c1ccco1)S(=O)(=O)c2ccccc2
|
|
628
|
c1ccc2c(c1)CC(=O)c3cccn3C2
|
|
629
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
630
|
CCOC(=O)N1CCC2C([NH]OC2=O)CC1
|
|
631
|
CSc1c(c([nH]n1)N)C#N
|
|
632
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
633
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
634
|
CCOC(=O)c1ccc(=O)c2cccc3c2c1C=C3
|
|
635
|
Cc1c(c(on1)N)C2=CCCCC2
|
|
636
|
Cc1c2ccccc2nc(n1)C
|
|
637
|
CCc1nnc(o1)Cn2cnc3ccccc3c2=O
|
|
638
|
c1cc(oc1)/C=c/2c(=O)[nH]/c(=Cc3ccco3)/c(=O)[nH]2
|
|
639
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
640
|
c1ccc2c(c1)[C@@H]3C[C@H]2C(=O)c4c3cccc4
|
|
641
|
c1cc2c(cc(=O)oc2cc1O)N
|
|
642
|
Cc1c(c(on1)C)COn2c3cc(ccc3nn2)C(F)(F)F
|
|
643
|
Cc1c(noc1N2CCOC2=O)C
|
|
644
|
C1C2C(NCN1)SC=C(N2)O
|
|
645
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
646
|
c1ccc(cc1)[C@@H]2C3=C(c4ccccc4CC3)NC(=O)N2
|
|
647
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
648
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
649
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
650
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
651
|
c1cc(sc1)n2c(nnn2)[O-]
|
|
652
|
c1nnc2n1nc3c(c2[O-])CCC3
|
|
653
|
c1ccc2c(c1)C(=O)c3cccc4c3C2=NNS4(=O)=O
|
|
654
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
655
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
656
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
657
|
c1ccc(cc1)C(=O)c2c3ccccn3nn2
|
|
658
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
659
|
CCOc1cc(no1)Oc2ccccc2
|
|
660
|
c1ccc(cc1)c2c(cno2)c3nnnn3c4ccccc4
|
|
661
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
662
|
CSc1cnc2ccccc2n1
|
|
663
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
664
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
665
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
666
|
c1ccc(cc1)n2c3c(cn2)c(ncn3)N
|
|
667
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
668
|
C1CCN(CC1)c2[n-]nnn2
|
|
669
|
C=CC[C@@H]1C(=NC(=NC1=O)N)O
|
|
670
|
c1ccc(cc1)Cc2nnco2
|
|
671
|
c1cc2c3c(c1)C(=O)CC3=CCCC2
|
|
672
|
COC(=O)c1cc(=O)nc(s1)N
|
|
673
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
674
|
C1CCC(CC1)C2=NCC=CC3C2CCCC3
|
|
675
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
676
|
c1ccc(cc1)C2(C(=O)NC(=N2)O)c3ccccc3
|
|
677
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
678
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
679
|
Cn1c2ccccc2n3c1n[nH]c3=O
|
|
680
|
c1c2n(cn1)[C@@H](CCC2)CCCC#N
|
|
681
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
682
|
c1ccc2c(c1)cc(c(=O)o2)C(=O)n3cccn3
|
|
683
|
c1cc2c(nc1)nc(s2)Cl
|
|
684
|
c1cc2cc(sc2nc1)CO
|
|
685
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
686
|
CN1CC2C(N1)CNN(C2=O)C
|
|
687
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
688
|
COC(=O)[C@@H](Cc1cncn1Cc2cc(cc(c2)Cl)Cl)N
|
|
689
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
690
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
691
|
C/C=c/c(cc(n/c1=C(C)/O)C)n2cncn2
|
|
692
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
693
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
694
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
695
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
696
|
c1csc(c1C#N)n2cc(c(=O)[nH]c2=O)C#N
|
|
697
|
CC1(Nc2ccccc2-c3n1nnn3)C
|
|
698
|
c1cc(cnc1)[C@@H]2CC(=O)Nc3c2c4c(s3)CCCC4
|
|
699
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
700
|
CC1COC2C1C(=C)C3C(C(CC(C3C2=O)O)OC)C
|
|
701
|
Cc1nc2ccccc2c(=O)n1c3nc[nH]n3
|
|
702
|
C1CCC2C(C1)CC3CCCC4C3[C@@H]2N=C4
|
|
703
|
c1cncc(c1Sc2nnns2)S(=O)(=O)N
|
|
704
|
c1ccc2c(c1)ncc(n2)C#N
|
|
705
|
c1cnc(cn1)c2nnc(o2)N
|
|
706
|
c1ccc(cc1)c2nc(cs2)Cn3c4ccccc4nn3
|
|
707
|
C[C@@H](c1ccno1)Oc2ccccc2
|
|
708
|
Cc1ccc(cc1)S(=O)(=O)Nn2c3ccccc3nn2
|
|
709
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
710
|
C=CCN1C2CCCCC2C(C1O)C3=C4CCCCC4=NC3=O
|
|
711
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
712
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
713
|
Cc1c(c(n(n1)C)Sc2ccc(cc2)Cl)C(=O)N
|
|
714
|
C[C@@]1(C(=O)N2CCCCCC2=N1)O
|
|
715
|
Cc1[nH]c(=O)c2c(n1)N=C(C[C@@H]2c3ccccc3)O
|
|
716
|
c1coc2c1cc(cc2O)F
|
|
717
|
CS(=O)(=O)Oc1nnc2n1nc(s2)OS(=O)(=O)C
|
|
718
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
719
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
720
|
CC(=O)N1CC=CC[C@@]2([C@H]1CCC2)C(=O)[O-]
|
|
721
|
Cc1cc(c(c(=O)o1)[C@@H]2c3ccccc3C(=O)O2)O
|
|
722
|
c1cn2cc(nc2cn1)C(=O)[O-]
|
|
723
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
724
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
725
|
C[C@@]12CCC(=O)N1c3ccccc3N2
|
|
726
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
727
|
c1cc(oc1)c2nc([nH]n2)N
|
|
728
|
CC=NC2CCCCC2/C1=C/3C4CCCCC4C(=O)NN3
|
|
729
|
c1ccc(cc1)Sn2c3ccccc3nn2
|
|
730
|
c1c(c2c(s1)nns2)C#N
|
|
731
|
CC1C(NN2C(NC(C2N1)C(=O)N)C)C
|
|
732
|
c1cc2c(cc1Cl)-c3c(c[nH]n3)CS2
|
|
733
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
734
|
c1cnc(c(n1)C(=O)[C@@H]2CCOC2)Cl
|
|
735
|
c1c2c(n[nH]1)[C@H]3[C@@H]([C@@H](C2=O)CC3=O)NCCC#N
|
|
736
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
737
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
738
|
|
|
739
|
Cn1c(ncn1)C(=O)C2CC2
|
|
740
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
741
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
742
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
743
|
CCOC(=O)c1nccnn1
|
|
744
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
745
|
C[C@@H]1NC(=O)c2ccccc2O1
|
|
746
|
CCCn1c(ccn1)C2CC2
|
|
747
|
COc1cc(n[nH]c1=O)Cl
|
|
748
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
749
|
COC(=O)N1CCc2c(s[nH]c2=O)C1
|
|
750
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
751
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
752
|
CCc1n[n-]/c(=N/C(=O)c2c(c(c(c(c2F)F)F)F)F)/s1
|
|
753
|
COc1cc2c(cc1OC)[C@@H]3C=C[C@H]2O3
|
|
754
|
Cc1nnc2n1CCCCC2
|
|
755
|
c1cc2cccc3c2c(c1)OS3(=O)=O
|
|
756
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
757
|
Cn1c(=O)c(c(n(c1=O)C)Oc2cccnc2)C#N
|
|
758
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
759
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
760
|
C1CCC(CC1)S(=O)(=O)C2=CC3CCCC4C3C2CCC4
|
|
761
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
762
|
C1CCN(C1)c2c(nns2)CO
|
|
763
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
764
|
c1cc2cn[nH]c2c(c1)S(=O)(=O)[O-]
|
|
765
|
c1cc(ccc1SCc2ccsc2c3ncns3)Cl
|
|
766
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
767
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
768
|
COC(=O)c1c(ccs1)n2cc(c(=O)[nH]c2=O)C#N
|
|
769
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
770
|
c1c(c(=O)nc2n1CCO2)C#N
|
|
771
|
CC(C)c1nc([nH]n1)CC#N
|
|
772
|
c1ccc(cc1)N2CCNC2=O
|
|
773
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
774
|
C1CCc2c(nc(s2)N)C1
|
|
775
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
776
|
Cn1cnc(c1C#N)n2oo2
|
|
777
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
778
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
779
|
CC(=O)N[C@@H]1CCC2CCCCC2-C3C1CC(=O)CCC3
|
|
780
|
COC1CC2C3C(C1)SCC(=O)N3NN2
|
|
781
|
COCCn1c(=O)ccc(n1)C(=O)n2c3ccccc3c(n2)N
|
|
782
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
783
|
c1ccc2c(c1)CCC3=C2CCC(=O)N3
|
|
784
|
Cc1cc(c(=O)n(c1)Cc2cccc(c2)F)NS(=O)(=O)C
|
|
785
|
COCCSc1nnc(n1C2CC2)c3c[nH]c4c3cccc4
|
|
786
|
C1COCCN1c2nnc(o2)N
|
|
787
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
788
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
789
|
Cc1cc2c(s1)NC(=O)CN=C2c3cccs3
|
|
790
|
|
|
791
|
|
|
792
|
C1CCC2C(C1)-C3C(CNCN3)S(=O)(=O)CO2
|
|
793
|
c1ccc(cc1)N2C3=CCCC[C@H]3C(=O)C2=O
|
|
794
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
795
|
c1ccc(cc1)n2cc(cn2)CSc3nncs3
|
|
796
|
C1CC/C(=C(C#N)/c2nnc3n2CCCC3)/NCC1
|
|
797
|
COc1c2ccccc2[nH+]c3c1cco3
|
|
798
|
c1nc(c2c(ncn2n1)C#N)[O-]
|
|
799
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
800
|
CC1CCC(CC1)S(=O)(=O)N2CCN3C2C(CN3)C#N
|
|
801
|
CC(C)(C(=O)[O-])n1cnnn1
|
|
802
|
COC(=O)c1c(snn1)[N-]S(=O)(=O)c2ccccc2
|
|
803
|
C1CCC2C(C1)CCN2[C@@H]3C4CCCCC4C(=O)O3
|
|
804
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
805
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
806
|
c1cnc(nc1)N2CCc3c(ccs3)C2
|
|
807
|
Cn1cccc1CNc2[n-]nnn2
|
|
808
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
809
|
Cn1c(cc(=O)n(c1=O)C)Cn2ccccc2=O
|
|
810
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
811
|
c1cc2nccn2c(c1)Cl
|
|
812
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
813
|
C1CCN(C(=O)C1)[C@@H]2C[C@@H]([C@@H](O2)CO)O
|
|
814
|
c1ccc(cc1)[C@@]2(CC[NH2+][C@H]3[C@H]2CCCC3)O
|
|
815
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
816
|
Cc1c2cccnc2sn1
|
|
817
|
C[C@]1(c2ccccc2O[C@H]1n3c4ccccc4nn3)CO
|
|
818
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
819
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
820
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
821
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
822
|
Cc1c(c(on1)N)Sc2ccc(cc2)Br
|
|
823
|
C1=N[C@@H]2[C@@H](C(=O)N1)N=CN2[C@@H]3[C@@H]([C@@H]([C@@H](O3)CO)O)O
|
|
824
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
825
|
CCnccn2c(/c1=Nc3ccccc3)nnn2
|
|
826
|
|
|
827
|
CC(=O)NC1=C(c2ccccc2C1)S(=O)(=O)[O-]
|
|
828
|
CCCSc1c(nns1)C
|
|
829
|
c1cc(sc1)c2cncnc2
|
|
830
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
831
|
CC1=C[C@@H](c2c(=O)[nH]c(=O)[nH]c2O1)c3ccccc3
|
|
832
|
c1ccc2c(c1)Cc3ccccc3N=C2C#N
|
|
833
|
CCc1c(ccc(c1c2cccs2)S(=O)(=O)[O-])C
|
|
834
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
835
|
C1CCN2C(C1)C(C(N2)F)C(F)(F)F
|
|
836
|
COC(=O)/C=c/c(=O)[nH]c(=C)s1
|
|
837
|
CC1=CC(=O)Nc2cccc3c2n1nc3
|
|
838
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
839
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
840
|
|
|
841
|
CC(=O)NC1CCC2C(C1)NCNN2
|
|
842
|
c1ccc2c(c1)ncc3n2c(=O)on3
|
|
843
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
844
|
CC1=C([C@@]2(C(=O)c3ccccc3[C@@]2(N1)O)O)C(=O)C
|
|
845
|
c1ccc(cc1)n2cnc3c2c4ccccc4c(=O)o3
|
|
846
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
847
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
848
|
CCc1ccc(cn1)SC
|
|
849
|
CC1CC([NH]/C(=NC(=O)CC2C(CCCC2CL)F)/C1)C
|
|
850
|
|
|
851
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
852
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
853
|
Cc1cc(c(nn1)C)SC
|
|
854
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
855
|
CCN(c1ccccc1)C2=CC(=O)N[C@@H]3N2CCCC3
|
|
856
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
857
|
Cc1nnc-2n1C(Cc3c2cccc3)(C)C
|
|
858
|
Cc1nc(no1)Cn2cccc(c2=O)C(F)(F)F
|
|
859
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
860
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
861
|
C1CC2N(C1)-C3C(CCS3)CN=C2
|
|
862
|
C=Cc1c(c(c2n1cccc2)c3c4ccccc4c(=O)[nH]n3)N
|
|
863
|
c1cnc(nc1)Sc2cnnc(c2Cl)[O-]
|
|
864
|
Cc1c(cc2c(n1)nc(o2)[O-])c3ccncc3
|
|
865
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
866
|
CN1[C@@H](C(=O)N=C1N)[C@@]2(c3ccccc3NC2=O)O
|
|
867
|
CCOC(=O)c1c(onn1)C
|
|
868
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
869
|
c1ccc2c(c1)Cc3cnc4ccccc4c3N2
|
|
870
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
871
|
CC1=Nc2ccccc2C1(C)C
|
|
872
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
873
|
c1ccc2c(c1)nc3n2C=CC3
|
|
874
|
|
|
875
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
876
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
877
|
C1CC(OC1)N2C(=O)C(C[NH]C2=O)F
|
|
878
|
Cc1cnn(c1)C(=O)c2c(noc2C)C
|
|
879
|
Cc1c(oc(n1)Cn2c(=O)c3ccccc3nn2)C
|
|
880
|
COCCSc1nnc(o1)c2c[nH]c3c2cccc3
|
|
881
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
882
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
883
|
c1cc2c3c(c1)CC[C@@H]3CCC2
|
|
884
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
885
|
CC1(Cc2ccccc2/C(=C/C(=O)N)/C1)C
|
|
886
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
887
|
CCOC(=O)C1=C(N=CC[C@@H]1C)C
|
|
888
|
CCSc1cc(ncn1)N
|
|
889
|
C1NC2C(C(N1)N)NCNC2N
|
|
890
|
CC1C(N2C(NCN2)NN1)N(C)C3CCCCC3
|
|
891
|
c1ccc(cc1)c2c3c(oc(=O)c2C(=O)[O-])C[C@@H](C=C3)O
|
|
892
|
Cc1nc2ccccc2c(=O)o1
|
|
893
|
c1ccc2c(c1)nc(c(=O)o2)N
|
|
894
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
895
|
c1cc(sc1)C(=O)c2cnc3n2cccn3
|
|
896
|
C1CCC2C(C1)C=C[C@@H]3[C@H]2[C@@H]4CCCC[C@@H]4O3
|
|
897
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
898
|
C1CCC2C(C1)-C3CCCC4C3[C@@H]2OC4=O
|
|
899
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
900
|
CC1(Cc2c(sc(=O)nc2N)C1)C
|
|
901
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
902
|
c1cc2c(c(c1)F)N3CCC[C@@H]3[C@@]4(C2)C(=O)COC4=O
|
|
903
|
c1ccc2c(c1)cccc2C[C@@H]3NCC=N3
|
|
904
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
905
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
906
|
COc1cc2c(c3c(oc2=O)C(=O)CC3)c(c1OC)OC
|
|
907
|
|
|
908
|
c1ccc(cc1)S(=O)(=O)Oc2ccccc2c3nnco3
|
|
909
|
|
|
910
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
911
|
CC(=O)c1ccc2nnnn2c1
|
|
912
|
c1ccc(cc1)Nc2nncs2
|
|
913
|
CCc1nnc(o1)Cn2c(noc2=O)c3ccccc3
|
|
914
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
915
|
Cc1c2c(c(cnc2[nH]n1)n3c4ccccc4nn3)c5ccccc5
|
|
916
|
CC1=C(C2(CCN(CC2)C(=O)C)OC1=O)C(=O)[O-]
|
|
917
|
COc1c2c(ncn1)SCC(=O)N2
|
|
918
|
Cc1c(c(c2ncnn2n1)[O-])Cl
|
|
919
|
CC[C@@]1(C(=O)NC(=N1)c2c(cccn2)C(=O)[O-])C
|
|
920
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
921
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
922
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
923
|
Cc1cc(c(c(c1)O)c2c(c[nH]n2)c3nc(cs3)C)O
|
|
924
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
925
|
c1ccc(cc1)c2c(scn2)Cn3cnc4cnccc4c3=O
|
|
926
|
c1ccc(cc1)Nn2c3ccccc3nn2
|
|
927
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
928
|
CC(C)NC1=C2C(=Nc3c(ncnc3S2)OC)CC(C1)(C)C
|
|
929
|
Cc1nc2n(n1)C3=CC(CC(=O)C3=NN2)(C)C
|
|
930
|
CC[C@H](C)[C@@H]1C(=Nc2ccccc2C(=N1)O)O
|
|
931
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
932
|
CC(=O)n1c2ccccc2c3c1oc(c3C(=O)OC)C(=O)OC
|
|
933
|
c1ccn2c(c1)nc3c2C(=O)CC3
|
|
934
|
c1cc2c(cc1F)C(=O)NC2
|
|
935
|
|
|
936
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
937
|
c1ccc2c(c1)CCC3=C(CC2=O)C(=O)OC3
|
|
938
|
Cc1nc2c(s1)c(nnc2[O-])c3ccco3
|
|
939
|
|
|
940
|
Cc1c(c(n[nH]1)O)[C@@H]2c3ccccc3C(=O)O2
|
|
941
|
CCOC1CCCC2N1CNN2
|
|
942
|
CCC1=C([C@@H](C(=O)N=C1C)N)OC2C[C@@H](C[C@@H](C2)C)C
|
|
943
|
c1ccc(cc1)C2=CCNn3cnnc3S2
|
|
944
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
945
|
Cc1c2c(n(n1)C)N(C(=O)CN(C2=O)C)C
|
|
946
|
c1ccc(cc1)S(=O)(=O)[N-]c2cccnc2
|
|
947
|
CCOC(=O)C1=C(N=C(N[C@H]1c2ccccc2)O)C
|
|
948
|
C=C=CCC(=O)N1CCCC1
|
|
949
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
950
|
C#Cc1ccc2c(c1)nccn2
|
|
951
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
952
|
C1CCc2c(c3n(n2)CCNC3=O)C1
|
|
953
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
954
|
CC1([C@@H](C=NC(=O)N1)c2ccccc2)C
|
|
955
|
Cc1c(cco1)c2nnc(n2C)SC
|
|
956
|
c1ccc(cc1)S(=NC(=O)c2ccco2)c3ccccc3
|
|
957
|
C1C[C@@H]2C(=O)NCC(=O)N2C1
|
|
958
|
CC1CC(N(N1)C2CC(NNC2)[O-])C
|
|
959
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
960
|
c1ccc(cc1)S[C@@H]2CCc3c2cccc3
|
|
961
|
CCOC(=O)[C@@]12CCC[C@@]1(NC(=O)C3C2CCNC3)O
|
|
962
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
963
|
CN1c2ccccc2[C@@H]3C=Cc4ccccc4[C@H]1C3=O
|
|
964
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
965
|
CO/C/1=c/2ccccc2=C/C=c/cccc/c3=[NH+]1
|
|
966
|
[H]/N=C/NC(=C2[C@@H]([C@@H](C(=O)N=C2N1)C#N)c3ccccc3)[O-]
|
|
967
|
c1cc2c(nc1)S[C@@]3(C2=O)CCOC3=O
|
|
968
|
c1c(noc1N)C2CCCC2
|
|
969
|
CCOC(=O)c1c(ocn1)[C@@H]2COC(O2)(C)C
|
|
970
|
CC(C)(C)OC(=O)N(C)c1ccnc2c1cc[nH]2
|
|
971
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
972
|
C1=C([C@H]2C(=NC1=O)C(=C(S2)SCC#N)C#N)[O-]
|
|
973
|
c1nc-2c3nc(on3cnc2n1)[O-]
|
|
974
|
c1cc2ccn3c2c(c1)CCC3
|
|
975
|
c1ccc(cc1)c2c(cc(=O)[nH]n2)[O-]
|
|
976
|
COC1NC2CCCCC2NN1
|
|
977
|
c1cc2c(cc1Cl)-c3c(snn3)CS2(=O)=O
|
|
978
|
C[C@@]1([C@@H]2CCCN2C(=O)O1)CO
|
|
979
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
980
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
981
|
C1Cc2c(non2)-c3c1non3
|
|
982
|
CN1CNC(=O)c2c1n[nH]n2
|
|
983
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
984
|
c1[nH]c(=O)c2c(n1)NCCC2
|
|
985
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
986
|
c1ccnc(c1)N2[C@@H](N3CCC[C@@H]3C2=O)c4cccnc4
|
|
987
|
Cc1c(nnn1c2ccccc2)S(=O)(=O)c3ccccc3
|
|
988
|
CC1=Cc2c(ccc3c2non3)N(C1)C
|
|
989
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
990
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
991
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
992
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
993
|
CC1(Cc2c(sc(c2C#N)NC)CO1)C
|
|
994
|
Cnccs/c1=NC(=O)Cc2cccs2
|
|
995
|
c1ccc(cc1)N2C=NC=NCC2=O
|
|
996
|
Cn1c(=O)n2n(c1=O)[C@H]3C[C@@H]2C=C3
|
|
997
|
CC1=C(OC2=NC(=O)C[C@@]12C#N)C
|
|
998
|
CCOC(=O)CCC1NC(C(C2N1NNN2)C)C(=O)OCC
|
|
999
|
CSc1nc(c(s1)C#N)N
|
|
1000
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Nc3ccc4c(c3)OCO4
|
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