(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
2
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
3
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
4
|
c1cc(ccc1Cn2c(=O)oc(n2)c3ccoc3)C#N
|
|
5
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
6
|
c1cc(oc1)c2cc3nc4c(c(n3n2)[O-])SCC4
|
|
7
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
8
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
9
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
10
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
11
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
12
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
13
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
14
|
CC1CCCC(N1)C2[N-]NNN2
|
|
15
|
Cc1cc(no1)Cn2cnc3ccccc3c2=O
|
|
16
|
|
|
17
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
18
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
19
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
20
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
21
|
CC(C)Oc1cc(on1)c2[n-]nnn2
|
|
22
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
23
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
24
|
CC1C(SC(N1)C[C@@H](C)N2CC(CN2)CL)C(=O)C
|
|
25
|
CC1CC2CC3CCCNN3C2NN1
|
|
26
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
27
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
28
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
29
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
30
|
CCc1nc2ccsc2c(n1)c3ccccn3
|
|
31
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
32
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
33
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
34
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
35
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
36
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
37
|
CC(=O)Nc1nccc(n1)c2cc(no2)c3ccccc3
|
|
38
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
39
|
CN1NC(NN1)C2[N-]NNN2
|
|
40
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
41
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
42
|
CCCCN1Cc2c(nc3cc(nn3c2[O-])C(C)(C)C)C1=O
|
|
43
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
44
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
45
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
46
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
47
|
Cc1ccnc(c1)Nc2ccc(nn2)NCCNC(=O)C
|
|
48
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
49
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
50
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
51
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
52
|
c1cc(oc1/C=C/2C(=NC(=O)N2)[O-])N3CCCC3
|
|
53
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
54
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
55
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
56
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
57
|
Cc1nn2cc(nc2s1)Cn3cnc4c(c3=O)cccc4OC
|
|
58
|
c1cc(oc1)c2cn3c(n2)sc(n3)c4ccco4
|
|
59
|
c1ccc2c(c1)c(=O)cc(o2)c3cc(cc4c3OCOC4)Cl
|
|
60
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
61
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
62
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
63
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
64
|
c1ccnc(c1)SCCn2cccn2
|
|
65
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
66
|
Cc1csc(n1)Cc2nc(no2)c3ccc(cc3)O
|
|
67
|
Cc1c(nn2cc(nc2n1)c3ccccc3)C
|
|
68
|
c1ccc(cc1)C2=N/C(=Cc3ccc4c(c3)OCO4)/C(=N2)O
|
|
69
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
70
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
71
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
72
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
73
|
Cn1cnc2c(c1=O)n(nc2C(=O)[O-])c3ccc(cc3)F
|
|
74
|
c1ccc(cc1)c2nnn(n2)Cn3c(=O)c4ccccc4nn3
|
|
75
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
76
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
77
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
78
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
79
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
80
|
Cc1c(=O)n2c(nn1)n(cn2)Cc3ccccc3
|
|
81
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
82
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
83
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
84
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
85
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
86
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
87
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
88
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
89
|
Cc1nc(cs1)Cn2c(=O)oc(n2)c3ccc(cc3)F
|
|
90
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
91
|
c1ccc(c(c1)/C=c/c(n/c(=C/C(=O)N3CCCC3)/s2)[O-])O
|
|
92
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
93
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
94
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
95
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
96
|
c1ccc(cc1)c2cc(nc(n2)C(=O)Nc3[n-]nnn3)O
|
|
97
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
98
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
99
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
100
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
101
|
CC(=O)N1CCC(CC1)c2nnc(s2)c3ccco3
|
|
102
|
Cn1c(cc(=O)n(c1=O)C)Cn2nc(nn2)c3ccccc3
|
|
103
|
Cc1cc(=O)n2c(n1)sc(n2)Cn3nc(nn3)c4ccccc4
|
|
104
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
105
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
106
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
107
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
108
|
Cc1cc(no1)CSc2nc(c(o2)C)C
|
|
109
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
110
|
Cn1c2c(cn1)c(ncn2)Sc3nnc(o3)c4cccnc4
|
|
111
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
112
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
113
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
114
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
115
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
116
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
117
|
c1ccc(cc1)c2nnc(o2)Sc3nc4ccccc4s3
|
|
118
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
119
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
120
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
121
|
Cc1cc(c(o1)C)c2cnnc(n2)N3CC[C@@H](C3)COC
|
|
122
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
123
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
124
|
Cc1cc(no1)CSc2ccccn2
|
|
125
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
126
|
|
|
127
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
128
|
CSc1nc2c(cc(s2)c3ccccc3)nn1
|
|
129
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
130
|
|
|
131
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
132
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
133
|
[H]/N=c/n(nc(s1)N2CCOCC2)Cc3ccccc3
|
|
134
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
135
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
136
|
c1cc(nnc1n2cncn2)[O-]
|
|
137
|
c1cc(oc1)/C=C/c2nn3cnnc3s2
|
|
138
|
Cn1c2ccccc2nc1Cn3nc(nn3)c4ccccc4
|
|
139
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
140
|
Cc1ccc(cc1)c2ncc(o2)Sc3ccccc3
|
|
141
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
142
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
143
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
144
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)no2
|
|
145
|
C1CCN(CC1)c2[n-]nnn2
|
|
146
|
c1ccc2c(c1)cnn(c2=O)Cc3ccon3
|
|
147
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
148
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
149
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
150
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
151
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
152
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
153
|
Cc1cc(no1)c2nnc(o2)N
|
|
154
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
155
|
Cc1nc(cs1)c2nnc(o2)N
|
|
156
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
157
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
158
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
159
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
160
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
161
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
162
|
CCOc1nnc(s1)Cn2nc(nn2)c3ccccc3
|
|
163
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
164
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
165
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
166
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
167
|
CC(C)(C)c1csc(n1)c2ccc(nc2)n3cncn3
|
|
168
|
CC1(CCc2c(ccc3c2cc(o3)c4ccccn4)O1)C
|
|
169
|
Cc1c(cn(n1)c2ccccn2)N3C[C@@H](CC3=O)C(=O)[O-]
|
|
170
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
171
|
Cc1nc(c(o1)C(F)(F)F)c2nc(on2)c3ccccc3
|
|
172
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
173
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
174
|
Cc1cc(nc(n1)C)n2c3ccccc3nn2
|
|
175
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
176
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
177
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
178
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
179
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
180
|
C1CC(OC1)C2CNC3C(N2)C(NC(N3)N)N
|
|
181
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
182
|
c1cc(oc1)c2ccnc(n2)N
|
|
183
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
184
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
185
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
186
|
Cc1csc(n1)c2nnc(o2)N
|
|
187
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
188
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
189
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
190
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
191
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
192
|
CC1NC2C(S1)NC(NN2)C3CCCCC3
|
|
193
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
194
|
|
|
195
|
CCc1nnc(o1)Cn2cnc3ccccc3c2=O
|
|
196
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
197
|
c1cnn(c1)c2cncc(n2)Cl
|
|
198
|
|
|
199
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
200
|
Cc1cc(no1)Cn2cnc(n2)C#N
|
|
201
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
202
|
c1cc(sc1)C2=COC3(C2)CCN(CC3)C(=O)c4cnccn4
|
|
203
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
204
|
Cc1ccc2nc(cn2c1)Cn3nc(nn3)c4ccccc4
|
|
205
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
206
|
c1cocc1c2nc(no2)C(=O)[O-]
|
|
207
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
208
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
209
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
210
|
C1CN(C1)c2nnc(nn2)N3CCC3
|
|
211
|
Cc1nc(n(n1)CCNC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
212
|
c1cc2c(cc1c3ccncc3)scc(c2=O)C(=O)N
|
|
213
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
214
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
215
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
216
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
217
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
218
|
Cc1c(nc(c(n1)C(=O)NC)NC)CCC(=O)[O-]
|
|
219
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
220
|
CC(C)(C#CC(=O)[O-])C#CC(=O)[O-]
|
|
221
|
Cc1ccc(nc1)n2cnnn2
|
|
222
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
223
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
224
|
c1cnc(cn1)c2nnc(o2)N
|
|
225
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
226
|
C1COCCN1c2[n-]nnn2
|
|
227
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
228
|
c1cc(ccc1/N=C(/Nc2[n-]nnn2)O)Cl
|
|
229
|
Cc1cc(no1)Cn2nc(nn2)c3ccccc3
|
|
230
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
231
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
232
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
233
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
234
|
Cn1c(=O)c(nn(c1=O)c2ccccc2)c3nc(on3)[O-]
|
|
235
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
236
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
237
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
238
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
239
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
240
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
241
|
Cc1c(oc(n1)Cn2nc(nn2)c3ccccc3)C
|
|
242
|
C[C@@H](c1ccncn1)N(C)Cc2ccc(o2)Sc3ncccn3
|
|
243
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
244
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
245
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
246
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
247
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
248
|
|
|
249
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
250
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
251
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
252
|
c1ccc(cc1)c2c(non2)/N=c/3c(nss3)Cl
|
|
253
|
CC1=C(Oc2ccccc2O1)c3ccccn3
|
|
254
|
c1ccc2c(c1)nc3c(c(oc3n2)N4CCCC4)C#N
|
|
255
|
Cc1c(=O)n2c(nn1)sc(n2)c3ccco3
|
|
256
|
CCOC(=O)c1cc(no1)c2c(non2)N3CCOCC3
|
|
257
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
258
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
259
|
CC(=O)NCC1CNCCN1
|
|
260
|
c1cnc(nc1c2nccs2)N
|
|
261
|
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)[O-])c2ccco2
|
|
262
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
263
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
264
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
265
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
266
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
267
|
|
|
268
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
269
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
270
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
271
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
272
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
273
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
274
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
275
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
276
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
277
|
CCOc1c2c(cc([nH]2)C(=O)OCC)nc(n1)OCC
|
|
278
|
|
|
279
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
280
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
281
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
282
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
283
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
284
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
285
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
286
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
287
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
288
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
289
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
290
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
291
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
292
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
293
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
294
|
c1cnccc1c2cc3n(n2)CCNC3=O
|
|
295
|
[H]/N=c/n(nc(s1)c2cccs2)CC(=O)c3cccs3
|
|
296
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
297
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
298
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
299
|
c1cc(nnc1n2cnnn2)Cl
|
|
300
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
301
|
CC(=O)c1c-2n(n(c1=O)c3ccccc3)C(=O)c4c2nccn4
|
|
302
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
303
|
Cc1c(sc2c1/c(=[NH+]/Cc3cn4ccccc4n3)/nc[nH]2)C
|
|
304
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
305
|
c1ccc2c(c1)nc3n2CCC(=C3C(=O)Nc4ccccn4)[O-]
|
|
306
|
CCOC(=O)c1cnn2c1nnn(c2=O)c3ccccc3
|
|
307
|
c1ccc(cc1)c2ccc(nn2)n3cnnc3
|
|
308
|
Cn1c(nnc1Sc2cnccn2)c3ccc(cc3)F
|
|
309
|
Cc1c(non1)c2c3c(non3)n(n2)C(=O)C
|
|
310
|
Cc1cc(n(n1)C(=O)c2c(nc(s2)Nc3ccccc3)C)C
|
|
311
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
312
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
313
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
314
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
315
|
|
|
316
|
|
|
317
|
COC(=O)CC1=Nc2nncn2C1=O
|
|
318
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
319
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
320
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
321
|
CCCCCCNC(=O)n1cc(c(nc1=O)[O-])F
|
|
322
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
323
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
324
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
325
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
326
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
327
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
328
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
329
|
Cc1ccc(cc1)c2nc(c(nn2)C)Sc3ccc(cc3)F
|
|
330
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
331
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
332
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
333
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
334
|
c1ccc(c(c1)C2=N/C(=C/c3ccco3)/C(=O)N2)Cl
|
|
335
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
336
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
337
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
338
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
339
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
340
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
341
|
Cc1ccc(cc1)Nc2cc(cs2)[C@@]3(CCC(=O)O3)C
|
|
342
|
Cc1c(c(n(n1)Cc2nc(cs2)C(C)(C)C)C)Br
|
|
343
|
c1cc(oc1)c2nc(on2)CO
|
|
344
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
345
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
346
|
Cc1cc(n(n1)CCc2nnc(n2C)SC)C
|
|
347
|
Cc1cc(no1)/N=C(C)/Cc2nc(sn2)NC[C@H]3CCCO3
|
|
348
|
COCCn1c(=O)ccc(n1)C(=O)n2c3ccccc3c(n2)N
|
|
349
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
350
|
CC(C)(C)OC(=O)N[C@@H](CS(=O)(=O)[O-])C(=O)[O-]
|
|
351
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
352
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
353
|
c1ccc2c(c1)nc3c(n2)Oc4ccccc4N3
|
|
354
|
CCOC(=O)c1c(c(cn1C)NC(=O)OCc2ccccc2)O
|
|
355
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
356
|
c1cc(nn2c1ncc(c2=O)N)N3CCCC3
|
|
357
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
358
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
359
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
360
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
361
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
362
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
363
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
364
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
365
|
c1ccc(cc1)n2c(c-3sc4ccccc4nc3c2=O)[O-]
|
|
366
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
367
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
368
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
369
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
370
|
|
|
371
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
372
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
373
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
374
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
375
|
COc1ccc(cc1)/C=C/C(=O)N=C(S2)CC(=O)C3CC3
|
|
376
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
377
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
378
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
379
|
Cc1ccc(cc1)c2nnn(n2)CCn3c4ccccc4oc3=O
|
|
380
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
381
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=NC(=N2)N3CCOCC3)[O-]
|
|
382
|
c1ccc(cc1)n2cc(cn2)Cn3cc(c(nc3=O)[O-])C#N
|
|
383
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
384
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
385
|
Cc1ccc(cc1)n2c(nnn2)c3nc4ccccc4s3
|
|
386
|
CCOC1NNC(S1)CSC2CCCCN2
|
|
387
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
388
|
Cn1cnc2c(c1=O)noc2C(=O)c3ccccc3
|
|
389
|
C1NC([NH]N1)NC2=NCCO2
|
|
390
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
391
|
Cc1ccc(cc1)c2[n-]nnn2
|
|
392
|
Cc1nc(no1)CSc2nncs2
|
|
393
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
394
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
395
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
396
|
CCc1c2cc(ccn2c(=O)c3c1s[nH]c3=O)c4ccncc4
|
|
397
|
c1cc(oc1)c2csc(n2)CC#N
|
|
398
|
CC(=O)OC/C=C/c1cccnc1
|
|
399
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
400
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
401
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
402
|
CCc1c(nco1)C(=O)N2CCC(CC2)c3cc(=O)[nH]c(n3)C
|
|
403
|
Cn1c(cc(n1)Oc2ccc(cn2)C(F)(F)F)C(F)(F)F
|
|
404
|
c1ccc(cc1)c2nn(c(=O)o2)CN3CCOCC3
|
|
405
|
c1ccc(cc1)CCC2=N[C@H](C=C2)C(=O)c3ccc4c(c3)OCO4
|
|
406
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
407
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
408
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
409
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
410
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
411
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
412
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
413
|
c1ccc2c(c1)c(=O)c(=Nc3ccccn3)c2=O
|
|
414
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
415
|
C[C@@H](c1nc2ccccc2o1)n3c4ccccc4nn3
|
|
416
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
417
|
c1cnoc1c2nnc(o2)N
|
|
418
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
419
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
420
|
COc1ccccc1O[C@@H]2C(=O)NC(=NC2=O)c3ncccn3
|
|
421
|
c1cc(oc1)C(=O)c2nccs2
|
|
422
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
423
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
424
|
Cc1c2cnc3ccccc3n2nn1
|
|
425
|
Cc1csc(n1)SCC2=NS(=O)(=O)c3ccccc3N2
|
|
426
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
427
|
c1cnn(c1)c2ccc(cc2)c3cnco3
|
|
428
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
429
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
430
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
431
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
432
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
433
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
434
|
CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1C(=O)OC)n2cnnn2
|
|
435
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
436
|
c1ccc2c(c1)c(=O)n(nn2)Cn3cnc(n3)C#N
|
|
437
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
438
|
c1ccc(cc1)n2c3c(c(ncn3)[O-])nn2
|
|
439
|
Cc1c(=O)nc([nH]n1)c2cccs2
|
|
440
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
441
|
c1cc(ccc1Oc2nc(ns2)Cl)F
|
|
442
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
443
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
444
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
445
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
446
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
447
|
c1ccc2c(c1)nc3c(noc3n2)[O-]
|
|
448
|
|
|
449
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
450
|
c1ccc2c(c1)nn(n2)C3=CC(=O)N=[NH+]3
|
|
451
|
c1cc(oc1)c2cc(no2)CO
|
|
452
|
COc1cc(=O)nc(o1)c2ccco2
|
|
453
|
Cc1csc(n1)Sc2nnc(s2)c3ccccc3
|
|
454
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
455
|
c1cc(oc1)c2c(snn2)C(=O)[O-]
|
|
456
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
457
|
Cc1c(c2nnnn2c(n1)c3ccccn3)Cl
|
|
458
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
459
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
460
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
461
|
C1CCC(CC1)CC2=NCOC2=O
|
|
462
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
463
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
464
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
465
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
466
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
467
|
CC1NC(ON1)C2CNCCN2
|
|
468
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
469
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
470
|
Cc1cnc(o1)Cn2cccn2
|
|
471
|
CC(=O)c1csc(n1)c2ccno2
|
|
472
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
473
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
474
|
Cc1c(cc2c(c(sc2n1)c3nnc(o3)C)N)C(=O)C
|
|
475
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
476
|
COc1ccccc1c2ncc(s2)c3nnc4n3cccc4
|
|
477
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
478
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
479
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
480
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
481
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
482
|
COc1cccc(c1)C2=CCN(CC2)Cn3cnc(n3)C(=O)OC
|
|
483
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
484
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
485
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
486
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
487
|
c1cc(cnc1)NCc2csnn2
|
|
488
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
489
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
490
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
491
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
492
|
c1cc(ncc1C#N)Sc2nccs2
|
|
493
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
494
|
c1ccc(cc1)C(=O)Nc2cnc3n(c2=O)ncs3
|
|
495
|
c1ccc(cc1)n2c(nc(n2)Cl)c3ccco3
|
|
496
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
497
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
498
|
c1ccnc(c1)SCc2ccco2
|
|
499
|
c1ccc2c(c1)nc(o2)c3ccco3
|
|
500
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
501
|
C[S@@](=O)c1ccc(nn1)n2cccc2
|
|
502
|
Cc1ccc(nc1)n2cccc2
|
|
503
|
CC(C)(C)C(=O)OCSc1nc(no1)c2cccnc2
|
|
504
|
C[C@@H](c1ccno1)Oc2ccccc2
|
|
505
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
506
|
c1cc(oc1C#CC(=O)[O-])Br
|
|
507
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
508
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
509
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
510
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
511
|
CN1CC(=C(C1=O)O)c2ccc(cn2)Cc3ccc(cc3)F
|
|
512
|
CC(C)C1C(C2CC3C(CC2NN1)C4CCCCC4O3)N
|
|
513
|
Cc1c(non1)COc2ccc(cc2)C(=O)[O-]
|
|
514
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
515
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
516
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
517
|
Cc1ccc(cc1)n2c(c(nn2)C(=O)n3c(cc(n3)C)C)C
|
|
518
|
Cc1c(nn2c(n1)nnn2)C
|
|
519
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
520
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
521
|
Cc1c-2c(n(n1)c3ccccn3)CCc4c2onc4
|
|
522
|
Cc1cc2nc(cc(=O)n2o1)N(C)Cc3ccsc3
|
|
523
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
524
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
525
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
526
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
527
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
528
|
CCOC(=O)[C@@H](C#N)C1=NCCC1
|
|
529
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
530
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
531
|
c1ccc(cc1)c2ccncn2
|
|
532
|
c1ccc(cc1)n2c(nnn2)n3c4ccccc4nn3
|
|
533
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
534
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
535
|
c1ccc(cc1)c2ncc(cn2)OC(=O)Cc3ccccc3F
|
|
536
|
Cc1cc(no1)c2nnnn2c3ccc(cc3)F
|
|
537
|
c1cc(oc1)c2nsc(=O)o2
|
|
538
|
CCC(=O)n1c(nc(n1)[C@@H](C)OC)[C@@H](C)OC
|
|
539
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
540
|
c1cnccc1c2nc3n(n2)CCC3
|
|
541
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
542
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
543
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
544
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
545
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
546
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
547
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
548
|
Cc1cc(n(n1)c2nc3c(c4ccccc4[nH]3)nn2)C
|
|
549
|
c1ccc2c(c1)nc3c(n2)nc[n-]3
|
|
550
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
551
|
C=CCc1cc2nccn2cn1
|
|
552
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
553
|
C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)CCNc2ccccn2
|
|
554
|
CCOC=C(c1nnco1)c2nnco2
|
|
555
|
Cc1c(nc2ccccc2n1)c3cscn3
|
|
556
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
557
|
c1cc2c(nc1)n(c(=O)o2)CCN3CCOCC3
|
|
558
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
559
|
CCOC(=O)c1nc2c(s1)NCCCC2
|
|
560
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
561
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
562
|
|
|
563
|
Cn1c2c(cn1)c(ncn2)n3cccn3
|
|
564
|
Cc1csc(=O)n1CCC(=O)[C@@H](C#N)c2ccccn2
|
|
565
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
566
|
CN(C)c1ccc(cc1)[C@@H]2NC[C@@H](O2)CSc3ccccn3
|
|
567
|
Cc1cc(nc(n1)Nc2nc(on2)COc3ccccc3)C
|
|
568
|
c1cc(oc1)c2nnc3n2nc(cc3)Cl
|
|
569
|
CC[C@@H](CCC(=O)/N=c/ccn([nH]1)c2ccccc2)C(=O)[O-]
|
|
570
|
CSc1nc(cc(n1)n2cnc3c2cccc3)c4ccccc4
|
|
571
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
572
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
573
|
CCOc1nnc(s1)CN2CCOCC2
|
|
574
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
575
|
Cc1cc(no1)c2cc(=O)[nH]c(n2)SC
|
|
576
|
c1ccn(c1)c2ccc(nn2)Cl
|
|
577
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
578
|
c1cc(cnc1)CCNCc2cscn2
|
|
579
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
580
|
c1ccc2c(c1)c(no2)/C=C/c3ccncc3
|
|
581
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
582
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
583
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
584
|
c1ccc(cc1)c2ccccn2
|
|
585
|
Cc1c(oc(n1)Cn2c(=O)c3ccccc3nn2)C
|
|
586
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
587
|
c1cc2c(nc1C#N)CCCN2
|
|
588
|
Cc1c(non1)c2cn3cc(ccc3n2)Br
|
|
589
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
590
|
c1cc(oc1)c2cc(on2)N
|
|
591
|
Cc1cc(nc(n1)SC)n2ccc(=O)[nH]c2=O
|
|
592
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
593
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
594
|
CCc1cc2c(cc1OC(=O)C)oc3cn4ccccc4c3c2=O
|
|
595
|
CSc1nc(n(n1)c2nncn2N)N
|
|
596
|
|
|
597
|
c1ccc(cc1)n2cc(cn2)c3c4cc(ccc4on3)F
|
|
598
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
599
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
600
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
601
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
602
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
603
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
604
|
Cc1cc(=O)n2c(n1)sc(n2)n3cnc(n3)C#N
|
|
605
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
606
|
|
|
607
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
608
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
609
|
Cc1cc(nc(n1)n2c(=O)ccc(n2)[O-])C
|
|
610
|
c1ccc(cc1)n2c(=O)c3cnc4c(c3[nH]2)cc(s4)C(=O)[O-]
|
|
611
|
Cc1ccc(cc1)c2ncns2
|
|
612
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
613
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
614
|
C1CCC(CC1)/C=C/C2NC(NC(N2)N)N
|
|
615
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
616
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
617
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
618
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
619
|
Cc1c2cnn(c(=O)c2c(s1)NC(=O)C)c3ccccc3
|
|
620
|
Cc1c2c(nc3ccccc3n2)n(n1)c4nccs4
|
|
621
|
Cc1ccc(nc1C)c2ccoc2
|
|
622
|
c1cc(c(nc1)c2ccco2)N
|
|
623
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
624
|
C[S@@](=NCn1c2ccccc2nn1)(=O)c3ccccc3
|
|
625
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
626
|
Cc1c(c(=O)on1C(=O)N(C)c2ccccn2)C(C)C
|
|
627
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
628
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
629
|
C#CCCCNc1c(=O)n(cc(n1)Cl)c2ccccc2
|
|
630
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
631
|
CC(=O)c1cc2c(cco2)nc1
|
|
632
|
c1ccc(cc1)n2ncc(n2)c3[n-]nnn3
|
|
633
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
634
|
Cc1nc(cs1)c2ccnc(n2)N
|
|
635
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
636
|
Cn1ccnc1Oc2ccc(cc2)Cl
|
|
637
|
CC1NC2C(NCNC2NN1)N
|
|
638
|
c1ccc(cc1)n2cc3c(n2)Nc4ccccc4O3
|
|
639
|
CC1=Nc2c(c(nc(n2)N3CCCCC3)N)C1=O
|
|
640
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
641
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
642
|
c1cc2c(c3c1[nH]cn3)c(c(cn2)c4[n-]nnn4)O
|
|
643
|
Cc1nnc(o1)CSc2ccccn2
|
|
644
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
645
|
c1ccc2c(c1)c(=O)n(nn2)Cn3c(=O)oc(n3)c4cccs4
|
|
646
|
Cc1cc(=O)n2c(n1)sc(n2)Sc3ncnn3N
|
|
647
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
648
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
649
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
650
|
c1ccc(cc1)c2c(oc(=O)o2)c3ccccc3
|
|
651
|
CC(=O)O[C@@H]1CC([C@H](O1)OCc2ccccc2)(F)F
|
|
652
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
653
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
654
|
COCCCn1cnc2c(c1=O)c3c(o2)nc4ccccc4n3
|
|
655
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
656
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
657
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
658
|
C1CCC2C(C1)C(=O)N-3C(N2)CSC4C3CCCC4
|
|
659
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
660
|
c1ccc(cc1)c2nn3c(=O)c4ccccc4nc3o2
|
|
661
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
662
|
Cc1c2c(c(no2)c3ccccc3)nc(n1)C
|
|
663
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
664
|
C1CCC(CC1)NC2=NC3C(CCCC3C(=O)[O-])C2=O
|
|
665
|
c1ccc(cc1)n2ccc(n2)Nc3nccc(n3)C(F)(F)F
|
|
666
|
Cn1cc(c(n1)c2ccncc2)c3ccc4c(c3)C(=O)NC4
|
|
667
|
|
|
668
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
669
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
670
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
671
|
C1CCC(CC1)C2NCC3N2NCN3C4CCCCC4
|
|
672
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
673
|
CC(=O)Nc1nnc(s1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
674
|
c1ccc(cc1)c2ccc(cc2)c3cc(c4c(n3)ocn4)C(=O)[O-]
|
|
675
|
CC(=O)N[C@@H]1[C@@H]2CN3[C@H]1[C@H](O2)CC3
|
|
676
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
677
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
678
|
|
|
679
|
c1cc(oc1)c2nccs2
|
|
680
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
681
|
CC(C)N1CNc2nc(nn2C1)C(F)(F)F
|
|
682
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
683
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
684
|
Cc1ccc(=O)n(c1)C(=O)c2cc(cc(n2)c3ccccc3)OC
|
|
685
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
686
|
CCn1cc(cn1)Nc2nccc(n2)OC
|
|
687
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
688
|
Cc1cc(nn1C)c2nnc(s2)NC
|
|
689
|
c1ccnc(c1)c2nnc(s2)c3ccc(cc3O)O
|
|
690
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
691
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
692
|
Cn1cc(nc1C(=O)[O-])NC(=O)c2cccs2
|
|
693
|
CSc1nccc(n1)c2cnoc2
|
|
694
|
c1ccc2c(c1)c(=O)n(s2)c3nccs3
|
|
695
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
696
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
697
|
c1c(c(n(n1)C(=O)CCN2CCOC2=O)N)C#N
|
|
698
|
COC(=O)CC1=NCCOC1=O
|
|
699
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
700
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
701
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
702
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
703
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
704
|
Cc1c2cc3c(nc2n(n1)C)C(=O)OCC3
|
|
705
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
706
|
C=CCOC1CCNC(N1)N
|
|
707
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
708
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
709
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
710
|
Cc1nnc(s1)SCSc2ccccn2
|
|
711
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
712
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
713
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
714
|
CC1=N[C@@H](C(=N[C@@H](C1)c2ccc(cc2)Cl)C#N)C#N
|
|
715
|
c1ccc2c(c1)NCCC(=N2)c3ccco3
|
|
716
|
c1cc2c(cc1C#N)C[C@@H](O2)c3ccc(o3)Br
|
|
717
|
c1ccc(cc1)c2cn(nn2)c3ccccc3
|
|
718
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
719
|
c1ccc2c(c1)c3noc(=O)n3cn2
|
|
720
|
C1C[C@@]2(C=C[C@@]3(O2)CCCO3)OC1
|
|
721
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
722
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
723
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
724
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
725
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
726
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
727
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
728
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
729
|
|
|
730
|
CN1c2ccccc2[C@@](C1=O)(c3nnc(o3)c4ccccc4)O
|
|
731
|
CC1(COC(=N1)/C=C/c2ccccc2)C
|
|
732
|
Cc1cn2c(nc(nc2n1)c3ccccc3)N
|
|
733
|
COC1=CC=C2[C@@H](N1)Sc3c(=O)[nH]c(nc3N2)N
|
|
734
|
Cc1c(nnn1c2nc(nc(n2)OC)N(C)C)C(=O)C
|
|
735
|
c1cc2c(nc1)Nc3c(cccn3)O2
|
|
736
|
c1ccnc(c1)SCc2c(snn2)Cl
|
|
737
|
c1ccc2c(c1)[nH]c(n2)n3cnnc3
|
|
738
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
739
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
740
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
741
|
C#Cc1cc2ccccc2nc1
|
|
742
|
CSc1cnc2ccccc2n1
|
|
743
|
CCCSc1ncc(cn1)CN[C@@H](CC)c2ncnn2C
|
|
744
|
C[C@@H](Cn1cc(cn1)Cl)c2cc(=O)[nH]c(n2)NC(C)C
|
|
745
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
746
|
c1ccc(cc1)n2c(=O)c(c(cn2)n3cc(nn3)CO)Cl
|
|
747
|
Cc1[nH]c(=O)c2c(n1)c3c(s2)NC(=O)C[C@@H]3c4ccccc4
|
|
748
|
c1ccc-2c(c1)-c3c2nc4ccccc4n3
|
|
749
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
750
|
Cc1cc(nc(n1)SC)C(=O)Nc2c(nsc2C)C
|
|
751
|
Cc1cc(c(o1)C)c2csc(n2)NC(=O)C
|
|
752
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
753
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
754
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
755
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
756
|
CN(CCO)c1cnccn1
|
|
757
|
Cc1nc(cs1)[C@@H]2COc3ccccc3O2
|
|
758
|
Cc1cc-2nc3ccc(cc3oc2cc1=[N+](C)C)N
|
|
759
|
CCC(=O)Cc1cnccn1
|
|
760
|
c1ccc(cc1)N2CCN(CC2)Cc3nnnn3Cc4ccco4
|
|
761
|
|
|
762
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
763
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
764
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
765
|
Cc1c2cc(sc2nc3c1[nH]c(cc3=O)[O-])c4cccs4
|
|
766
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
767
|
Cc1c(cno1)c2cn3ccccc3n2
|
|
768
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
769
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
770
|
c1ccc(cc1)n2c(c(nn2)c3nc4ccccc4s3)N
|
|
771
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
772
|
CN1CC(CN1)NC(=O)CCN2CCOC2=O
|
|
773
|
Cc1cc(c(o1)C)c2cc[nH]n2
|
|
774
|
Cc1cc(n(n1)c2ncccn2)C
|
|
775
|
C1CC(C(CC1O)C2=NCCC2)O
|
|
776
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
777
|
c1ccc(cc1)n2c3c(cn2)c(nnn3)[O-]
|
|
778
|
c1cc(oc1)c2nc([nH]n2)N
|
|
779
|
c1ccc(cc1)n2cc(nn2)c3nc(on3)c4ccc5cc[nH]c5c4
|
|
780
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
781
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
782
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
783
|
Cc1nnc(o1)[C@H]2CCN(C2)C(=O)C
|
|
784
|
Cc1nnc(s1)Sc2cc(nc(n2)N)Cl
|
|
785
|
c1ccc(cc1)Oc2nc3ccc(nn3c(=O)n2)Cl
|
|
786
|
CCNC(=O)Nc1nc2cc(ccn2n1)c3cccnc3
|
|
787
|
CC1CCC2C(C1)NC(C(=O)O2)C3CCCCC3
|
|
788
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
789
|
c1ccc(cc1)/C=C/CN2CCC(CC2)C#N
|
|
790
|
COC(=O)c1ccc(o1)[N-]S(=O)(=O)c2ccccc2
|
|
791
|
Cc1c(oc(c1C#N)NC(=O)CN2CCOCC2)C
|
|
792
|
Cc1cc(c(n1C)C)C(=O)COn2c3cc(ccc3nn2)Cl
|
|
793
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
794
|
C1CC(NNC1)/C=C/C2CCCO2
|
|
795
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
796
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
797
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
798
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
799
|
CCO[C@@H](C#Cc1ccccc1)n2cncn2
|
|
800
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
801
|
CCOC(=O)Cc1coc(n1)C
|
|
802
|
CCOC(=O)Cn1nc(nn1)CSc2ccc(cc2)Cl
|
|
803
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
804
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
805
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
806
|
c1cnccc1c2cnc3cc(nn3c2)O
|
|
807
|
c1ccc2c(c1)C(=NS2(=O)=O)Nc3ccccn3
|
|
808
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
809
|
c1csc(n1)c2nccs2
|
|
810
|
c1nc2c(c(n1)N)N=C[C@H]2[C@@H]3[C@@H]([C@H]([C@@H](O3)CO)O)O
|
|
811
|
C1CNC2C3CNC4C(C3NN2C1)CCS4
|
|
812
|
Cn1c2cc([nH]c2nc1SC)C(=O)OC
|
|
813
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
814
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
815
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
816
|
CCS(=O)(=O)c1ccc(s1)c2cccc(c2)c3cc[nH]n3
|
|
817
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
818
|
CC(C)(C)c1cnnc(n1)N
|
|
819
|
c1ccc2c(c1)/C(=N/c3ccccn3)/C(=O)N2
|
|
820
|
CCOc1nnc(s1)Cn2c(=O)c(c(c(n2)C)C)C#N
|
|
821
|
COC(=O)c1cc2c(cccn2)oc1=O
|
|
822
|
Cc1cc(ncn1)Nc2ccccc2
|
|
823
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
824
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
825
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
826
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
827
|
c1ccc(cc1)n2cnc(nc2=[NH2+])N
|
|
828
|
Cc1nn(c(=O)c2n1c3c(c2)ccs3)CCCC#N
|
|
829
|
c1cc2c(cc1C(F)(F)F)nc(s2)c3csnn3
|
|
830
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
831
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
832
|
Cc1c(nc(c(c1C#N)C#N)OC)/C=C/c2ccco2
|
|
833
|
|
|
834
|
Cc1c(cn(n1)CC=C)CNCc2c(nns2)C
|
|
835
|
C1Cc2c(nn(c2N)CCC#N)C1
|
|
836
|
Cc1ccnc(n1)n2cccc2
|
|
837
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
838
|
CCc1[nH]c(c2c(n1)nn3c2nnc(c3=O)C(C)(C)C)[O-]
|
|
839
|
COc1cc(nc(c1)C(=O)Nc2[n-]nnn2)c3ccc(cc3)N
|
|
840
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
841
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
842
|
Cc1c(c(n(n1)C)n2cncn2)N
|
|
843
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
844
|
c1cc(cc(c1)Cl)n2ccc(n2)c3cnccn3
|
|
845
|
c1cnnc2c1c(c(s2)C(=O)N)N
|
|
846
|
Cc1nnn(n1)Cc2nnnn2C
|
|
847
|
c1cc(cc(c1)C(F)(F)F)c2ccc(o2)c3csnn3
|
|
848
|
|
|
849
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
850
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
851
|
C=C1/C(=C/C2=CC3CCCCC3OC2)/C(=O)N([NH]1)C4CCCCC4
|
|
852
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
853
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
854
|
Cc1c(nn(c(=O)c1C#N)Cc2nc3ccccc3o2)C
|
|
855
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
856
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
857
|
CNc1nnc(s1)Sc2nnc(s2)NC
|
|
858
|
COC(=O)Cc1cccnn1
|
|
859
|
CCCN(C)c1ccc2c3c(cn2n1)c(nn(c3=O)C)Cl
|
|
860
|
c1ccc2c(c1)nnn2C3=NCCCC3
|
|
861
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
862
|
Cc1cnc(s1)Nc2cnc(nc2)SC
|
|
863
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
864
|
Cc1ccc(cc1)c2c(sc(n2)C)Cc3nnc(o3)N
|
|
865
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
866
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
867
|
c1cnccc1c2n[nH]c(=O)s2
|
|
868
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
869
|
Cc1ccn(n1)CC/N=C/[C@@H](C(=O)C2=O)NCCCOC
|
|
870
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
871
|
c1cnn(c1)CCSc2nncs2
|
|
872
|
COC(CNC1=Nc2c(cccn2)OC1)OC
|
|
873
|
CN1C=NC2C(NCN2[C@@H]3CC[C@@H](O3)CO)[C@@H]1O
|
|
874
|
Cc1c(sc(n1)CCn2cccc(c2=O)C(F)(F)F)C(=O)C
|
|
875
|
CC(C)(C)c1c(nc(nn1)n2cccc2)SC
|
|
876
|
c1ccc(cc1)c2ccc(=O)on2
|
|
877
|
Cn1cc(c(n1)C(F)(F)F)COC(=O)Nc2ccccc2
|
|
878
|
Cc1cc(nc(n1)Nc2[nH]ncn2)C
|
|
879
|
CC1C(NN2C(NC(C2N1)C(=O)N)C)C
|
|
880
|
CCOC(=O)Nc1c2c(ccn2C)n/c(=[NH+]C(=O)OCC)/s1
|
|
881
|
Cc1nc(on1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
882
|
c1nnc(s1)NC(=O)[C@H]2C(=C3CCCCC3=NC2=O)[O-]
|
|
883
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
884
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
885
|
c1ccc(cc1)OCCn2ccnc2
|
|
886
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
887
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
888
|
CCSc1nnc(s1)N/C(=C/Sc2ncccn2)/[O-]
|
|
889
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
890
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
891
|
Cn1cnc2c1ncc(c2)C#N
|
|
892
|
Cc1ncc(s1)CN(C)Cn2c(=O)oc(n2)c3ccccc3
|
|
893
|
c1ccnc(c1)c2csc(n2)[O-]
|
|
894
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
895
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
896
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
897
|
CNc1nnc(s1)c2cnccn2
|
|
898
|
CC(=O)C1C2C(NC(N1)C(=O)C)N(CN2)C(=O)C
|
|
899
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
900
|
Cc1c(sc(n1)Cc2nc(cs2)O)C
|
|
901
|
c1csc(n1)n2cnnn2
|
|
902
|
|
|
903
|
CNc1nc(nc(n1)n2cnc(n2)SC)NC
|
|
904
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
905
|
c1cnccc1c2cc3c(o2)CCNC3=O
|
|
906
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
907
|
c1c[nH]c2c1ncc(n2)Cl
|
|
908
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
909
|
CC(C)(C)C(=O)CC1=NC(=O)/C(=Cc2csnn2)/S1
|
|
910
|
CCOCc1cn(c(nc1=[NH2+])C)CC(=O)c2ccccc2
|
|
911
|
Cc1ccnn1CC/N=c/c(=N/CCCOC)/c(c2O)O
|
|
912
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
913
|
c1c2c(nc3c1c(=O)n(cn3)CC(=O)[O-])CCC2
|
|
914
|
CCNc1nc(nc(n1)Cl)Sc2nnc(s2)SC
|
|
915
|
CC1(COC(=N1)CCCOc2ccc(cc2Cl)Cl)C
|
|
916
|
Cc1c2c(nc(n1)n3cc(nn3)c4ccccc4)CCCC2
|
|
917
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
918
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
919
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
920
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
921
|
CCOC(=O)C1=NC2=CCn3ccnc3C2=C1
|
|
922
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
923
|
c1cc(oc1)c2nnc(s2)N
|
|
924
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
925
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
926
|
C1CCC(CC1)c2[n-]nnn2
|
|
927
|
c1ccc(cc1)NC(=O)c2nnc(s2)C(F)(F)F
|
|
928
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
929
|
CCC1NN2C(=O)NC(NC2S1)SC
|
|
930
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
931
|
c1c(=O)[nH]c2c(n1)CCCC2
|
|
932
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
933
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
934
|
Cc1c(nn(n1)c2ccccc2)C(=O)n3cccc3
|
|
935
|
CC1([C@@](c2ccccc2O1)(c3ccc4ccccc4n3)O)C
|
|
936
|
c1ccc2c(c1)c(=O)n(cn2)Cc3c(snn3)Cl
|
|
937
|
CCN1C[C@@H](CC1=O)NC(=O)Cc2c(non2)C
|
|
938
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
939
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
940
|
Cc1c2cc(cnc2n(n1)C)[N-]S(=O)(=O)c3cccs3
|
|
941
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
942
|
c1ccc2c(c1)nc3c(n2)Sc4c(cccn4)O3
|
|
943
|
COc1nc(nc(n1)OC)Nc2nccs2
|
|
944
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
945
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
946
|
CCSc1nnc(s1)/N=C(/C2CCC2)[O-]
|
|
947
|
c1cnccc1c2nnn(n2)CC#N
|
|
948
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
949
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
950
|
CSc1c(c(sn1)SC)NC(=O)OC[C@@H]2CCCO2
|
|
951
|
CSc1c(c([nH]n1)c2ccco2)C#N
|
|
952
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
953
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
954
|
C[C@@H]1CCc2c(c(on2)[C@@H]3CCCN(C3)C(=O)c4ccco4)C1
|
|
955
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
956
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
957
|
CC1CC2N(N1)C(=O)C3CC4CCCCC4CC3O2
|
|
958
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
959
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
960
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
961
|
CC1NC2C(CN(N2)CC3CCCCC3)C(=O)O1
|
|
962
|
c1ccc(cc1)S(=O)(=O)CC2=Nc3cccn3C2=O
|
|
963
|
CCCCC1C(OC(N1)C)CC=C
|
|
964
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
965
|
c1cnc(cn1)NC2=NCCN2
|
|
966
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
967
|
Cc1c(nn2c(=O)c(nnc2n1)C)[O-]
|
|
968
|
CCCCn1c(c(c2c1ncn(c2=[NH2+])c3nccs3)C)C
|
|
969
|
CS(=O)(=O)NCCOc1cc(ncn1)N2CCCC2
|
|
970
|
CNC(=O)C=NNS/C1=C/2C(=O)N(N=N2)c3ccccc3
|
|
971
|
CCCc1nc2c(o1)cccn2
|
|
972
|
c1cc(oc1)Cn2c(ccn2)N
|
|
973
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
974
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
975
|
c1ccc(cc1)c2nnn(n2)CCS(=O)(=O)N3CCOCC3
|
|
976
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
977
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
978
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
979
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
980
|
CC(C)NC(=O)c1ccc(o1)c2cncnc2
|
|
981
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
982
|
Cc1csc2n1c-3nc4ccccc4c3nn2
|
|
983
|
C1CC2C3C(C(NNN3)[O-])SC2NC1
|
|
984
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
985
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
986
|
Cc1ccc(cc1)n2cccn2
|
|
987
|
c1cc(cc(c1)Cl)n2c(=O)c3c(nc2[O-])non3
|
|
988
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
989
|
Cc1c(cnn1c2ccccc2)c3ccnn3C(=O)c4ccco4
|
|
990
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
991
|
Cc1c(=O)n2c(nn1)SCC(=N2)N
|
|
992
|
c1c2cc(oc2ncc1F)CO
|
|
993
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
994
|
Cc1c(sc(n1)Cn2cnc(c2Cl)Cl)C(=O)C
|
|
995
|
Cc1cccc(n1)C#CCSc2ccccc2
|
|
996
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
997
|
c1cnccc1c2cnc3c(cnn3c2)C4=CCCC4
|
|
998
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
999
|
CC(=O)c1cnc2n(c1=O)ncs2
|
|
1000
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
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