(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
2
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
3
|
c1ccc(cc1)n2c(nnn2)Sc3nc4ccccc4o3
|
|
4
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
5
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
6
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
7
|
Cc1cc(nc(n1)Sc2nc(nc(n2)Cl)NC)C
|
|
8
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
9
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
10
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
11
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
12
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
13
|
CCc1nnc(o1)Cn2c(noc2=O)c3ccccc3
|
|
14
|
Cc1cc(nc(n1)Sc2ccc(nn2)Cl)C
|
|
15
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
16
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
17
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
18
|
CCOc1nnc(s1)Cn2c(noc2=O)c3ccccc3
|
|
19
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
20
|
c1cnc(c(n1)C#N)NCc2nc3c(s2)CCCC3
|
|
21
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
22
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
23
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
24
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
25
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
26
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
27
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
28
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
29
|
|
|
30
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
31
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
32
|
|
|
33
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
34
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
35
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
36
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
37
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
38
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
39
|
CC(=C)c1nc(nc(n1)Oc2ccccc2)Oc3ccccc3
|
|
40
|
|
|
41
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
42
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
43
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4s3
|
|
44
|
|
|
45
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
46
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
47
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
48
|
Cc1nnn(n1)Cc2nnnn2C
|
|
49
|
c1cc(oc1)c2c(snn2)C(=O)[O-]
|
|
50
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
51
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
52
|
Cc1c(oc(n1)Cn2c(=O)c3ccccc3nn2)C
|
|
53
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
54
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
55
|
Cn1c(ncn1)C(c2ncnn2C)(C(=O)[O-])O
|
|
56
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
57
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
58
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
59
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
60
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
61
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
62
|
Cc1c(non1)c2c3c(non3)n(n2)C(=O)C
|
|
63
|
Cc1nc(no1)Cn2c(=O)n(nn2)c3ccccc3
|
|
64
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
65
|
CCCSc1[n-]s/c(=N/C(=O)CN2CCCC2)/n1
|
|
66
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
67
|
CNc1nnc(s1)c2cnccn2
|
|
68
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
69
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
70
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
71
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
72
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
73
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
74
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
75
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
76
|
CNc1nc(nc(n1)n2cnc(n2)SC)NC
|
|
77
|
c1nc2c(c(n1)N)N=C[C@H]2[C@@H]3[C@@H]([C@H]([C@@H](O3)CO)O)O
|
|
78
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
79
|
c1cc(sc1)CCc2c(cco2)C(=O)[O-]
|
|
80
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
81
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
82
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
83
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
84
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
85
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
86
|
|
|
87
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
88
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
89
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
90
|
CC(=O)NCC1CNCCN1
|
|
91
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
92
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
93
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
94
|
C[C@@H](c1ccncn1)N(C)Cc2ccc(o2)Sc3ncccn3
|
|
95
|
C[C@@H]1C(=NC(=NC1=O)c2ccccc2)C(=O)[O-]
|
|
96
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
97
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
98
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
99
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
100
|
c1cc(ccc1[C@@H](c2c(nc3nnc(n3n2)N)[O-])C(=O)[O-])Cl
|
|
101
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
102
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
103
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
104
|
c1ccc2c(c1)ncn2c3c(nns3)C(=O)N
|
|
105
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
106
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
107
|
c1ccc2c(c1)c(=O)n(nn2)Cn3c(=O)oc(n3)c4cccs4
|
|
108
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
109
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
110
|
c1c(c(n[nH]1)n2cnnc2)C(=O)[O-]
|
|
111
|
CN1NC(NN1)C2[N-]NNN2
|
|
112
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
113
|
CCNc1nc(nc(n1)Sc2ccc(cc2)C(=O)OC)N
|
|
114
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
115
|
Cc1cc2nc(nc(=O)n2o1)Oc3ccccc3
|
|
116
|
Cc1cc(no1)/N=C(C)/Cc2nc(sn2)NC[C@H]3CCCO3
|
|
117
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
118
|
CCOc1nc(nc(n1)N)C
|
|
119
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
120
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
121
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
122
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
123
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
124
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
125
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
126
|
c1cnc2c(n1)c(nnc2[O-])[O-]
|
|
127
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
128
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
129
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
130
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
131
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
132
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
133
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
134
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
135
|
c1ccc2c(c1)C3=NC(=N[C@H]3C2=O)C(=O)c4ccccc4C(=O)[O-]
|
|
136
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
137
|
c12c(c(n[nH]c1=O)[O-])non2
|
|
138
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
139
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
140
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
141
|
CSC1C2C(CCN1)N[NH]N2
|
|
142
|
Cc1c(oc(n1)Cn2nc(nn2)c3ccccc3)C
|
|
143
|
C(C#N)c1nc(nc(n1)N)N
|
|
144
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
145
|
Cn1c2c(cn1)nc[nH]c2=O
|
|
146
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
147
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
148
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
149
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
150
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
151
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
152
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
153
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
154
|
Cn1c2c(cccn2)nc(c1=O)[NH+]3CCC[C@@H]3C(=O)[O-]
|
|
155
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
156
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
157
|
|
|
158
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
159
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
160
|
|
|
161
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
162
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
163
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
164
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
165
|
c1cnc(nc1c2nccs2)N
|
|
166
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
167
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
168
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
169
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
170
|
Cc1cc(n(n1)c2nc(cc3n2ncn3)N)C
|
|
171
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
172
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
173
|
CC1CCCC(N1)C2[N-]NNN2
|
|
174
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
175
|
C1C2CC3CC1CC(C2)(C3)n4nc(c(n4)C(=O)[O-])C(=O)[O-]
|
|
176
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
177
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
178
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
179
|
CCOC(=O)CCC1NC(C(C2N1NNN2)C)C(=O)OCC
|
|
180
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
181
|
c1cnc(cn1)c2nnc(o2)N
|
|
182
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
183
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
184
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
185
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
186
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
187
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
188
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
189
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
190
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
191
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
192
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
193
|
CCNc1nc(nc(n1)Cl)Sc2nnc(s2)SC
|
|
194
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
195
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
196
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
197
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
198
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
199
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
200
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
201
|
CCc1ccc(s1)Nc2ncnc(n2)Cl
|
|
202
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
203
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
204
|
c1ccn2c(c1)nn(c2=O)CCn3c(noc3=O)c4cccs4
|
|
205
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
206
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
207
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
208
|
Cc1cc(nc(n1)N=C2NCCN2)C
|
|
209
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
210
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
211
|
|
|
212
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
213
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
214
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
215
|
CCSc1cc(ncn1)N
|
|
216
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
217
|
C1[C@@H]2N(C1=O)[C@@H](/C(=C/CO)/O2)C(=O)[O-]
|
|
218
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
219
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
220
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
221
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
222
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
223
|
C(#N)c1c(n2c(c(nnc2n1)C(=O)N)N)C#N
|
|
224
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
225
|
|
|
226
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
227
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
228
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
229
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
230
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
231
|
c1ccc(cc1)CS(=O)(=O)n2cnc3c2[nH]c(=O)[nH]c3=O
|
|
232
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
233
|
COc1cc(=O)nc(o1)c2ccco2
|
|
234
|
c1ccc(cc1)CNc2cnccn2
|
|
235
|
CCOC(=O)Cc1[nH]ncn1
|
|
236
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
237
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
238
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
239
|
c1ccc2c(c1)[nH]/c(=N/C3=NC(=O)C[C@@H](N3)C(=O)[O-])/s2
|
|
240
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
241
|
Cc1nc(nc(n1)Cl)Cl
|
|
242
|
Cc1c(non1)NCNc2c(non2)C
|
|
243
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
244
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
245
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
246
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
247
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
248
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
249
|
CCSc1ncnc(n1)N
|
|
250
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
251
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
252
|
c1cn2cc(nc2cn1)C(=O)[O-]
|
|
253
|
|
|
254
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
255
|
CCOC(=O)c1nn(c2n1c(=O)c(nn2)C)c3ccccc3
|
|
256
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
257
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
258
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
259
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
260
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
261
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
262
|
|
|
263
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
264
|
CCc1c(nco1)C(=O)N[C@@H]2CC(=O)N(C2)CC(C)(C)C
|
|
265
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
266
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
267
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
268
|
Cc1nc(n(n1)C(=O)c2cccs2)C
|
|
269
|
|
|
270
|
c1cc2c([nH]nc2Cl)nc1
|
|
271
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
272
|
CC1NC(ON1)C2CNCCN2
|
|
273
|
CC[C@@]1(C(=O)NC(=N1)c2c(cccn2)C(=O)[O-])C
|
|
274
|
CCOC(=O)Nc1c(n[nH]n1)Cl
|
|
275
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
276
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
277
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
278
|
Cc1csc(n1)c2c(non2)N
|
|
279
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
280
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
281
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
282
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
283
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
284
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
285
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
286
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
287
|
C1CCN(C1)S(=O)(=O)c2c(nc(nn2)[O-])[O-]
|
|
288
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
289
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
290
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
291
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
292
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
293
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
294
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
295
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
296
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
297
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
298
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
299
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
300
|
c1c(c(c(=O)n(n1)Cc2c(snn2)Cl)Cl)Cl
|
|
301
|
c1ccc(cc1)n2cnc(nc2=[NH2+])N
|
|
302
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
303
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
304
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
305
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
306
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
307
|
CN1CCN=C(C=C1c2ccccc2O)C(=O)[O-]
|
|
308
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
309
|
|
|
310
|
Cc1cc(c(c(c1)O)c2c(c[nH]n2)c3nc(cs3)C)O
|
|
311
|
COc1ncc(c2n1nc(n2)S(=O)(=O)[O-])F
|
|
312
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
313
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
314
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
315
|
c1ccc(cc1)c2c3c(c(ncn3)[O-])sn2
|
|
316
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
317
|
Cn1c(=O)c(nn(c1=O)c2ccccc2)c3nc(on3)[O-]
|
|
318
|
Cc1cc(n(n1)C(=O)c2cc(on2)C)C
|
|
319
|
Cn1c(cc(n1)Oc2ccc(cn2)C(F)(F)F)C(F)(F)F
|
|
320
|
|
|
321
|
Cc1c(nn2c(=O)c(nnc2n1)C)[O-]
|
|
322
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
323
|
C(C1[N-]NNN1)C2[N-]NNN2
|
|
324
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
325
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
326
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
327
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
328
|
CCCNC(=O)Cc1nc[nH]n1
|
|
329
|
CC(C)c1nc(cs1)CNC(=O)c2c(ocn2)C3CC3
|
|
330
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
331
|
C(c1c(non1)N)c2c(non2)N
|
|
332
|
Cn1cc(cn1)c2cnccn2
|
|
333
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
334
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
335
|
c1ccc(cc1)Oc2nc3ccc(nn3c(=O)n2)Cl
|
|
336
|
COc1nc(nc(n1)OC)C(=O)c2ccccc2
|
|
337
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
338
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
339
|
|
|
340
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
341
|
c1cnnc(n1)c2nccnn2
|
|
342
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
343
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
344
|
C1(=NS(=O)(=O)N=C1C(=O)[O-])C(=O)[O-]
|
|
345
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
346
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
347
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
348
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
349
|
COc1ccc(cc1)c2cnnn2Cc3ccco3
|
|
350
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
351
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc2cc(no2)C)[O-]
|
|
352
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
353
|
c1ccc2c(c1)CCN(C2)Cn3c(ncn3)c4ccccc4Cl
|
|
354
|
Cc1cc(nc(n1)Nc2cc(on2)C)C#N
|
|
355
|
CSc1nc2ncnn2c(n1)[O-]
|
|
356
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
357
|
c1ccc2c(c1)CCc3c(cc(cc3O2)N)N
|
|
358
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
359
|
CCCCn1c(nnn1)NC(=O)N(C)Cc2nc(no2)CC
|
|
360
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
361
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
362
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
363
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
364
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2c(=O)c3ccccc3nn2
|
|
365
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
366
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
367
|
Cc1nc2c(ncnc2o1)N
|
|
368
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
369
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
370
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
371
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
372
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
373
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
374
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
375
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
376
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
377
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
378
|
c1c(cnc(n1)C(F)(F)F)[O-]
|
|
379
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
380
|
Cc1nnc(o1)CSc2ccccn2
|
|
381
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
382
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
383
|
Cc1[nH]cc([nH+]1)S(=O)(=O)[N-]c2cc(nn2C)c3ccccc3
|
|
384
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
385
|
c1ccc(cc1)Oc2nc3ccccn3c(=O)n2
|
|
386
|
c1ccc(cc1)OCc2[nH]c(c/c(=N/c3ccc(cc3)Cl)/n2)O
|
|
387
|
c1ccc(cc1)c2nc(cc(=O)o2)[O-]
|
|
388
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
389
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
390
|
CC(C)c1c(nccn1)OC
|
|
391
|
c1ccc(cc1)c2cc(nc(n2)C(=O)Nc3[n-]nnn3)O
|
|
392
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
393
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
394
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
395
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
396
|
c1ccc(cc1)c2ccncn2
|
|
397
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
398
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
399
|
Cc1cc(n(n1)C)NS(=O)(=O)c2c(n(cn2)C)Cl
|
|
400
|
c1cc(sc1)c2ccncn2
|
|
401
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
402
|
c1csc2c1cc([nH]2)C(=O)[O-]
|
|
403
|
CC1NC(ON1)C2CCCO2
|
|
404
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
405
|
c1nc([nH]n1)c2c(non2)N
|
|
406
|
c1cc2c(cc1c3c4ccoc4ccn3)OCCO2
|
|
407
|
c1cnc(nc1)SCc2cc(=O)c(co2)O
|
|
408
|
C1CCC(CC1)C2NOC(=O)N2CC3CN4CCSC4N3
|
|
409
|
c1cnc(c(n1)C#N)n2ccnc2
|
|
410
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
411
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
412
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
413
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
414
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
415
|
CC(=O)NC1NCNC(N1)N
|
|
416
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
417
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
418
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
419
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
420
|
c1ccc(cc1)NC(=O)c2[n-]ncn2
|
|
421
|
CCCCCCC1CN[NH]N1
|
|
422
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
423
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
424
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
425
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
426
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
427
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
428
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
429
|
Cc1nc(no1)c2ncon2
|
|
430
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
431
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
432
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
433
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
434
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
435
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
436
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
437
|
CCOC(=O)c1cc(no1)c2c(non2)N3CCOCC3
|
|
438
|
c1([n-]nnn1)Nc2[n-]nnn2
|
|
439
|
Cn1cc(cn1)c2nnc(o2)SC
|
|
440
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
441
|
c1cc(cnc1)CNCCc2ccco2
|
|
442
|
CC1(CC2=C(c3c1c[nH]n3)Sc4ccccc4N2)C
|
|
443
|
CCC(=O)Nc1cnn(c1)Cc2nnnn2CCOC
|
|
444
|
CC1CC2CC3CCCNN3C2NN1
|
|
445
|
CCC(=O)Cc1cnccn1
|
|
446
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
447
|
Cc1nccc(n1)Sc2ccccc2
|
|
448
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
449
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
450
|
c1c2c(n[nH]c1=O)CCCC2
|
|
451
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
452
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
453
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
454
|
Cc1ccnn1CC/N=c/c(=N/CCCOC)/c(c2O)O
|
|
455
|
CCCn1c(cc(n1)C)NS(=O)(=O)c2ccc(cc2)C
|
|
456
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
457
|
c1ncn(n1)Cn2cncn2
|
|
458
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
459
|
Cc1cc(=O)n2c(n1)sc(n2)Sc3ncnn3N
|
|
460
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
461
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
462
|
c1ccc(cc1)c2nc(on2)SCC(=O)[O-]
|
|
463
|
c1cnccc1c2n[nH]c(=O)s2
|
|
464
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
465
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
466
|
Cn1c(ncn1)c2csc(n2)c3ccncc3
|
|
467
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
468
|
|
|
469
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
470
|
|
|
471
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
472
|
Cc1ccc(cc1)c2nnc(o2)c3c(cnc(n3)SC)Cl
|
|
473
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
474
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
475
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
476
|
|
|
477
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
478
|
CCOC(=O)c1c(c2c(nc(nc2n1C)c3ccccc3)C)N
|
|
479
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
480
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
481
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
482
|
|
|
483
|
c1coc2c1[nH]c(c2)C(=O)[O-]
|
|
484
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
485
|
Cc1c(non1)NCn2cnnn2
|
|
486
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
487
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
488
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
489
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
490
|
c1ccc(c(c1)C2=Nc3cncnc3NC2)N
|
|
491
|
Cc1c(cco1)c2nnc(o2)N
|
|
492
|
CC1NC(C(NN1)C(=O)N)[O-]
|
|
493
|
CC1NC2C(S1)NC(NN2)C3CCCCC3
|
|
494
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
495
|
C1C(C(C2C(C1F)N[NH]N2)N)F
|
|
496
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
497
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
498
|
c1c(nc(=O)n(n1)[C@@H]2CCCO2)N
|
|
499
|
CCC(=O)n1c(nc(n1)[C@@H](C)OC)[C@@H](C)OC
|
|
500
|
c1ccc2c(c1)cnn(c2=O)Cc3ccon3
|
|
501
|
Cc1nc(on1)[C@@H](C)Nc2nccc(n2)OC
|
|
502
|
c1ccc(cc1)n2c(cnn2)Cn3cnc4ccccc4c3=O
|
|
503
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
504
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
505
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
506
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
507
|
c1cn(cn1)c2cc(=O)[nH]c(n2)N
|
|
508
|
Cc1c(nccn1)c2ccn[nH]2
|
|
509
|
c1cnccc1c2nnc3n2CCC3
|
|
510
|
c1c[nH]nc1c2nccs2
|
|
511
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
512
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
513
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
514
|
Cc1ccc(cc1)n2c3c[nH]c(=O)nc3cn2
|
|
515
|
COC(=O)NS(=O)(=O)C1CCCO1
|
|
516
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
517
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
518
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
519
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
520
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
521
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
522
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
523
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
524
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
525
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
526
|
CCSC1C2C(CN[NH]2)NCN1
|
|
527
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
528
|
Cc1c(snn1)c2nnc3n2CCC3
|
|
529
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
530
|
Cc1ccc(cc1)S(=O)(=O)Nn2nc(nn2)c3ccccc3
|
|
531
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
532
|
Cc1ccc(cc1)S(=O)(=O)NC(=O)n2c(cc(n2)C)C
|
|
533
|
Cc1cc(c(nn1)N)C(=O)N
|
|
534
|
|
|
535
|
COc1c2cn[nH]c2ncn1
|
|
536
|
Cc1c2cnnc(n2cn1)Nc3cccnc3
|
|
537
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
538
|
c1cc(cnc1)NCc2csnn2
|
|
539
|
c1ccc-2c(c1)CCc3c2n[nH]c3
|
|
540
|
c1ccc(cc1)n2c(nnn2)Cn3c(nnn3)C4CCCC4
|
|
541
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
542
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
543
|
Cc1cc(ncn1)Nc2ccccc2
|
|
544
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
545
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
546
|
Cc1cnc(o1)Cn2cccn2
|
|
547
|
Cn1c(ncn1)C(=O)C2CC2
|
|
548
|
Cn1cc(c(n1)C(F)(F)F)COC(=O)Nc2ccccc2
|
|
549
|
c1ccc(cc1)c2nccnn2
|
|
550
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
551
|
c1cc(oc1)C(=O)c2nccs2
|
|
552
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
553
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
554
|
C1C2C(NC(N1)[O-])SNN2
|
|
555
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
556
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
557
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
558
|
c1cc(oc1)c2c(nns2)C(=O)N
|
|
559
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
560
|
c1ccnc(c1)C2=CCCCC2
|
|
561
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
562
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
563
|
Cc1nc(no1)CSc2nncs2
|
|
564
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
565
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
566
|
CN1CNC(=O)c2c1n[nH]n2
|
|
567
|
c1cnccc1c2ccnc3n2ncc3
|
|
568
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
569
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
570
|
CCc1c(nccn1)SC
|
|
571
|
Cc1c(n2c(ncn2)nn1)[O-]
|
|
572
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
573
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
574
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
575
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
576
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
577
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
578
|
|
|
579
|
Cc1cc(no1)c2nc(on2)C(C)(C)C
|
|
580
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
581
|
c1ccc(cc1)c2cc3c(nccn3n2)Cl
|
|
582
|
Cn1c2c(c(ncn2)[O-])nn1
|
|
583
|
c1ccnc(c1)[C@@H]2Nc3c(c4c(s3)CCCC4)C(=O)N2
|
|
584
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
585
|
Cc1csc(n1)c2nnc(o2)N
|
|
586
|
c1cc(ncc1C#N)NCc2nccs2
|
|
587
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
588
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
589
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
590
|
COC(=O)Nc1cn2c(n1)ccc(n2)C(=O)N
|
|
591
|
CSc1nccc(n1)c2cnoc2
|
|
592
|
CC(=O)Nn1cnc2c1cccc2
|
|
593
|
|
|
594
|
c1csc(n1)/N=C(/CN2CCOCC2)[O-]
|
|
595
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
596
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
597
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
598
|
Cc1ccc2nc(cn2c1)Cn3nc(nn3)c4ccccc4
|
|
599
|
c1cc(nnc1n2cncn2)[O-]
|
|
600
|
|
|
601
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
602
|
Cc1cc2n(n1)[C@@H](CC(=N2)O)C(=O)Nc3ccccc3F
|
|
603
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
604
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
605
|
Cc1nc(on1)c2c(non2)N
|
|
606
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
607
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
608
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
609
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
610
|
c1cnc(cn1)NC2=NCCN2
|
|
611
|
Cn1c(ccn1)c2c(snn2)C(=O)[O-]
|
|
612
|
C1CCC2C(C1)C(NO2)C[S@@](=N)(=O)[O-]
|
|
613
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
614
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
615
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
616
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
617
|
CC(=O)n1c(ncn1)SC
|
|
618
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
619
|
c1ccnc(c1)N[C@@H]2C[C@@H]3[C@H](O2)[C@@H](CO3)O
|
|
620
|
Cc1ccc(cc1)S(=O)(=O)[C@@H](C#N)c2c(nccn2)Cl
|
|
621
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
622
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
623
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
624
|
CCOc1c(c([nH]n1)N)C#N
|
|
625
|
Cc1cc(nc(n1)N)Nn2cnnc2
|
|
626
|
CCOc1c(nc(o1)C#N)C
|
|
627
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
628
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
629
|
CC1C(NC2C(N1)C(NNC2N)N)C
|
|
630
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
631
|
Cc1csc(n1)c2c(nns2)C
|
|
632
|
CC[C@@H](c1cnn(c1)C)NC(=O)c2c(ocn2)C
|
|
633
|
Cc1csc(n1)c2cn[nH]c2N
|
|
634
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
635
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
636
|
Cc1nc(n(n1)CCNC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
637
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
638
|
C1CC(OC1)C2CNC3C(N2)C(NC(N3)N)N
|
|
639
|
Cc1cc(no1)c2nnc(o2)N
|
|
640
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
641
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
642
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
643
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
644
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
645
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
646
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
647
|
CC1(Nc2ccccc2-c3n1nnn3)C
|
|
648
|
Cc1nnc(s1)Sc2cc(nc(n2)N)Cl
|
|
649
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
650
|
c1ccc(cc1)[N-]S(=O)(=O)CC2=NC(=O)n3cccc3C2=O
|
|
651
|
Cc1c(c(no1)C(=O)OC)c2cc[nH]n2
|
|
652
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
653
|
CCOC(=O)C=NN=C/C1=N/NSC2CCC(CC2)C
|
|
654
|
CN(C)c1nnnn1c2cccnc2
|
|
655
|
Cn1c(=O)c(nn(c1=O)C)Sc2ccccc2F
|
|
656
|
CC(C)c1nc(on1)[C@@H]2Cc3c([nH]c[nH+]3)CN2C(=O)C
|
|
657
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
658
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
659
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
660
|
Cc1[nH]c(=O)cc(n1)CSc2ccccc2
|
|
661
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
662
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
663
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
664
|
CC1=C(C[S@@](=O)N(C1)c2nc(sn2)SC)C
|
|
665
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
666
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
667
|
CNc1c2c(nccn2)ncn1
|
|
668
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
669
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
670
|
CCOc1ccc2c(nc(nc2c1)/N=C/NCCC(=N3)[O-])C
|
|
671
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
672
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
673
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
674
|
c1ccc(cc1)NC(=O)/C=c/c(nc3n2ncn3)O
|
|
675
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
676
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
677
|
Cc1cnc(o1)COc2ccccc2
|
|
678
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
679
|
c1ccnc(c1)NC(=O)c2[n-]nnn2
|
|
680
|
CC1(OC[C@@H]([C@@H](O1)[C@@H](C2[NH]C(C(N2)C#N)OC)O)O)C
|
|
681
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
682
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
683
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
684
|
COC(=O)Nc1/c(=N/C(=O)OC)/n(on1)[O-]
|
|
685
|
c1cc(oc1)/C=C/c2nn3cnnc3s2
|
|
686
|
Cc1cc(nc(n1)Nc2c(nn[nH]2)C(=O)C)C
|
|
687
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
688
|
Cc1cc(n(n1)C(=O)[C@@H]2[C@@H]3CC[C@H]([C@@H]2C(=O)[O-])O3)C
|
|
689
|
CS(=O)(=O)Nc1ncccn1
|
|
690
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
691
|
C1(=O)[NH]C(=O)N2N1[C@@H](NC2=O)O
|
|
692
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
693
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
694
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
695
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
696
|
Cc1ccc(nc1)n2cnnn2
|
|
697
|
c1(c(non1)N)c2nnc(o2)N
|
|
698
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
699
|
c1cc(c(cc1S(=O)(=O)[O-])C(=O)[O-])c2cn[nH]c2[O-]
|
|
700
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
701
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
702
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
703
|
CCCn1c(n[nH]c1=O)c2cccs2
|
|
704
|
c1ncn(n1)C[C@@H]2COC3(O2)CCCCC3
|
|
705
|
c1cc(oc1C(=O)[O-])S(=O)(=O)[O-]
|
|
706
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
707
|
Cc1c2ccccc2nc(n1)NC3=N[C@@H](C=C(N3)COC)O
|
|
708
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
709
|
C(CS(=O)(=O)[O-])C1[N-]NNN1
|
|
710
|
|
|
711
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
712
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
713
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
714
|
Cc1c(c(n(n1)C)n2cncn2)N
|
|
715
|
CC(=O)c1c(n[n-]n1)NC(=O)c2ccccc2
|
|
716
|
c1[nH]c(c(n1)C(=O)[O-])C(=O)[O-]
|
|
717
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
718
|
Cc1cnc(o1)CN2CCOCC2
|
|
719
|
Cc1cc(no1)CSc2nc(c(o2)C)C
|
|
720
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
721
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
722
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
723
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
724
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
725
|
CCC[C@@H]1N[C@@H](C(=N1)C(C)(C)O)C(=O)OCC
|
|
726
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
727
|
Cc1c2ccccc2c(nn1)Sc3nccn3C
|
|
728
|
Cc1c(sc(c1C(=O)[O-])n2cnnn2)C
|
|
729
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
730
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
731
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
732
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
733
|
Cc1nc(sn1)C2=CCCN(C2)C
|
|
734
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
735
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
736
|
Cc1cnc(nc1c2ncnn2C)N
|
|
737
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
738
|
c1cn(cn1)c2nc(nc(n2)Cl)N3CCCCC3
|
|
739
|
c1ccnc(c1)[S@@](=O)c2cncs2
|
|
740
|
CC(C)(C#Cc1nnn(n1)C)O
|
|
741
|
COc1ccc(cc1OC2CCCC2)c3ccc(nc3)C(=O)N
|
|
742
|
|
|
743
|
CC(C)N1C(NNN1)SC2CNN(C(=O)C2CL)C
|
|
744
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
745
|
c1cc2c(c(c1)S(=O)(=O)N)non2
|
|
746
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
747
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
748
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
749
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
750
|
C[C@@H]1CCc2c(c(on2)[C@@H]3CCCN(C3)C(=O)c4ccco4)C1
|
|
751
|
c1ccnc(c1)n[nH]/c2=NC(=O)C3CC3
|
|
752
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
753
|
CCc1nc(cn1/C(=C/C(=O)n2cc(nc2CC)C)/[O-])C
|
|
754
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
755
|
Cn1cc(cn1)c2ccncn2
|
|
756
|
Cn1c(ccn1)CNC(=O)Cn2cccnc2=O
|
|
757
|
CC1CCC(CC1)S(=O)(=O)C2CN[NH]N2
|
|
758
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
759
|
c1ccc(cc1)Cn2cnnn2
|
|
760
|
c12c([nH]c(=O)nc1onn2)[O-]
|
|
761
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
762
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
763
|
c1cc(oc1)c2nnc3n2CCCCC3
|
|
764
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
765
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
766
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
767
|
Cc1cc(n(n1)CCc2nc(on2)c3ccccc3)C
|
|
768
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
769
|
c1cncc2c1nc(o2)Cl
|
|
770
|
Cc1ccc(cc1)c2c(sc(n2)C)Cc3nnc(o3)N
|
|
771
|
c1cc(oc1)c2c(ncs2)C(=O)[O-]
|
|
772
|
Cc1ccc(n1c2[n-]c(nn2)SCCCC(=O)[O-])C
|
|
773
|
Cc1cc(nc(n1)Nc2ncc(n2c3ccccc3)O)C
|
|
774
|
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
|
|
775
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
776
|
CCc1nnc(o1)CN(C(C)C)C(=O)c2c(ocn2)C3CC3
|
|
777
|
C(#N)c1c(c2c(nc1N)non2)N
|
|
778
|
CC(=O)OCC1C(C(=O)C1=O)C2CCCCC2
|
|
779
|
CNC1C(=O)NC(SN1)SC2NC(=O)C(NS2)NC
|
|
780
|
Cc1c(c(nc(c1Cl)C)S(=O)(=O)n2ccnc2)C#N
|
|
781
|
COC(=O)c1cc(=O)nc(s1)N
|
|
782
|
c1ccc(cc1)c2ccccn2
|
|
783
|
CNc1nc(ns1)c2cccs2
|
|
784
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
785
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
786
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
787
|
CC(=O)N[C@@H](CS/N=N/c1ccccc1)C(=O)[O-]
|
|
788
|
c1cc(oc1)C2=CC(=O)Nc3c(non3)N2
|
|
789
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
790
|
c1ccnc(c1)CS(=O)(=O)[O-]
|
|
791
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
792
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
793
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
794
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
795
|
Cc1ccc(cc1)S(=O)(=O)NC(=O)n2ccnc2C
|
|
796
|
Cc1ccc(cc1C)c2c(cccn2)OC3(CCCC3)C(=O)[O-]
|
|
797
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
798
|
c1cnn(c1)Cc2nnc3n2CCC3
|
|
799
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
800
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
801
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
802
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
803
|
|
|
804
|
Cc1cc(nc(n1)SN2CCCCC2)C
|
|
805
|
c1ncn(n1)Sn2cncn2
|
|
806
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
807
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
808
|
c1ccc(cc1)NCn2cncn2
|
|
809
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
810
|
CCN1CNNC1C2C3CCCCC3SN2
|
|
811
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
812
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
813
|
c1cc(cnc1)CCNCc2cscn2
|
|
814
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
815
|
Cc1c(snn1)c2[nH]c3ccccc3n2
|
|
816
|
Cn1ccnc1COc2ccc(cc2)N
|
|
817
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
818
|
Cc1nc(c(o1)Sc2ccc(cc2)Cl)C#N
|
|
819
|
c1cc(=O)n(cc1C(F)(F)F)Cc2nnnn2C3CC3
|
|
820
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
821
|
CCOC(=O)c1c(onn1)C
|
|
822
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
823
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
824
|
CCCCN1CC(=O)N=C1Nc2ccccc2
|
|
825
|
c1ccc(cc1)c2c(cno2)c3nnnn3c4ccccc4
|
|
826
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
827
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
828
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
829
|
CCC(=O)c1cc(c(c(c1)Sc2cccc3c2nccc3)O)C
|
|
830
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
831
|
c1cnc(c(n1)C(=O)[C@@H]2CCOC2)Cl
|
|
832
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
833
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
834
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
835
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
836
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
837
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
838
|
Cc1c(non1)OCCOc2c(non2)C
|
|
839
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
840
|
Cc1c(sc(n1)C)c2nnc(o2)N
|
|
841
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
842
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
843
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
844
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
845
|
CSc1c(c([nH]n1)N)C#N
|
|
846
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
847
|
c1cc(oc1)c2ccnc(n2)N
|
|
848
|
CCSc1nnc(s1)/N=C(/C2CCC2)[O-]
|
|
849
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
850
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
851
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
852
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
853
|
c1ccc2c(c1)[C@@H]3N4[C@@H]2OCC4(CO3)CO
|
|
854
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
855
|
CCn1cc(cn1)[C@@H]2C[C@@H](N(S(=O)(=O)N2)C)C(=O)[O-]
|
|
856
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
857
|
CCOC(=O)c1c(ocn1)[C@@H]2COC(O2)(C)C
|
|
858
|
Cc1nc2c(s1)c(nnc2[O-])c3ccco3
|
|
859
|
Cc1ccc(cc1)S(=O)(=O)n2c(nnn2)[O-]
|
|
860
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
861
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
862
|
CC(=O)Nn1c2ccccc2nn1
|
|
863
|
CC(C)(C)OC(=O)N[C@@H](CS(=O)(=O)[O-])C(=O)[O-]
|
|
864
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
865
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
866
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
867
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
868
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
869
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
870
|
COc1nc(cnn1)c2cnnc(n2)OC
|
|
871
|
c1cc(oc1)c2ccnc3n2ncc3
|
|
872
|
c1ccc2c(c1)CC3=C2NC(=O)N[C@@H]3c4ccccn4
|
|
873
|
C1CCN(C1)c2c(non2)[O-]
|
|
874
|
c1cc(sc1)CCNc2ncccn2
|
|
875
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
876
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
877
|
|
|
878
|
c1ccc2c(c1)nnn2S(=O)(=O)c3ccco3
|
|
879
|
c1ccc2c(c1)[C@@]3(C(=O)N2)N=C(NC(=N3)N4CCOCC4)N
|
|
880
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
881
|
Cn1cnc2c(c1=O)noc2C(=O)c3ccccc3
|
|
882
|
c1c2c(c3c(c1Br)non3)nno2
|
|
883
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
884
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
885
|
CCOC(=O)C1=C(C(=O)NCC1)[O-]
|
|
886
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
887
|
|
|
888
|
|
|
889
|
|
|
890
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
891
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
892
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
893
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
894
|
c1ccc2c(c1)c3c([nH]2)nc4c(n3)non4
|
|
895
|
c1ccc(cc1)n2c(nnn2)n3c4ccccc4nn3
|
|
896
|
c1ccc-2c(c1)CSc3c2[nH]nc3O
|
|
897
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
898
|
c1ccc2c(c1)c(nnn2)Nc3ccccc3Cl
|
|
899
|
Cc1c(c(on1)C)c2nc(no2)CN3CCOCC3
|
|
900
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
901
|
c1ccc(c(c1)c2nc([nH]n2)CC(=O)[O-])O
|
|
902
|
c1ccc(cc1)S(=O)(=O)n2cncn2
|
|
903
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
904
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
905
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
906
|
CCc1nnc(o1)COC(=O)cc([n-]s/c2=NC)C
|
|
907
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
908
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
909
|
CS(=O)(=O)c1cnccn1
|
|
910
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
911
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
912
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
913
|
c1ccc(cc1)S(=O)(=O)[N-]c2ncccn2
|
|
914
|
CC1NC(CN1C)S(=O)(=O)[N-]C2CNN(C2)CC(=O)OC
|
|
915
|
Cc1c(non1)c2[n-]nnn2
|
|
916
|
CCCCC1C(OC(N1)C)CC=C
|
|
917
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
918
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
919
|
C1CCc2c(nc(nn2)N)C1
|
|
920
|
CC(C)(C(=O)[O-])n1cncn1
|
|
921
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
922
|
Cc1c(cn(n1)C)c2nnc(s2)NC
|
|
923
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
924
|
CC(=O)/N=c/c(nn(s1)C(=O)C)C(=O)N
|
|
925
|
CO[C@@]12CCC(=O)N1C=CC3C2[NH]C4C3CCCC4
|
|
926
|
c1ccc(cc1)Nc2ccccn2
|
|
927
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
928
|
Cc1c(nccn1)c2ccnn2S(=O)(=O)c3ccccc3
|
|
929
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
930
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
931
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
932
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
933
|
c1ccc(cc1)c2cnccn2
|
|
934
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
935
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
936
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
937
|
c1ccc(cc1)C2=N[C@@](C(=O)N2)(C(F)(F)F)Nc3ccccn3
|
|
938
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
939
|
CC1C(NON1)C(=O)N(C)C
|
|
940
|
c1cc(ccc1[C@@]2(CCOC2)c3nc(on3)c4ccsc4)F
|
|
941
|
Cn1c(nc(n1)/N=c/c(nss2)Cl)SC
|
|
942
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
943
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
944
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
945
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
946
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
947
|
C[C@@H]1[C@@H]([C@H]([C@@H](C(=N1)CO)O)O)O
|
|
948
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
949
|
c1ccc(cc1)CC2=CC(=O)[C@H](C=N2)[O-]
|
|
950
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
951
|
c1ccc(cc1)Nc2c3cn[nH]c3ncn2
|
|
952
|
CN(CC(=O)[O-])c1ncc2c(n1)C=CCC2
|
|
953
|
Cc1nc(no1)c2c(nns2)c3ccccc3
|
|
954
|
Cn1c(ccn1)c2nnc(o2)N
|
|
955
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
956
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
957
|
c1ccc(cc1)COc2cnc(nc2)C#N
|
|
958
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
959
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
960
|
c1nncn1c2[n-]c(nn2)N
|
|
961
|
C[C@@H](Nc1nccs1)n2cncn2
|
|
962
|
CC(C)N1Cn2c(nnc2SC1)c3ccccc3
|
|
963
|
CN1CNC2C1NNNC2[O-]
|
|
964
|
CC(=O)NSC[C@@H](C(=O)[O-])NC(=O)OC(C)(C)C
|
|
965
|
c1csc2n1cc(n2)Cc3nnc4n3CCC4
|
|
966
|
Cc1cc2nc(nc(n2n1)N)N
|
|
967
|
Cc1c(nnn1C)c2csnn2
|
|
968
|
Cc1c(scn1)c2[n-]c3cc(cnc3n2)Br
|
|
969
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
970
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
971
|
Cnccs/c1=NC(=O)c2ccc[nH]2
|
|
972
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
973
|
c1cc(cnc1)CS(=O)(=O)N
|
|
974
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
975
|
c1(c(n[nH]n1)C(=O)[O-])C(=O)[O-]
|
|
976
|
c1ccc2c(c1)nc3c(noc3n2)[O-]
|
|
977
|
C1CCC(CC1)C2CCNN2S(=O)(=O)C3=CC=CCC=C3
|
|
978
|
c1c([nH]nn1)SCC(=O)N
|
|
979
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
980
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
981
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
982
|
Cc1c(sc(n1)Cn2cnc(c2Cl)Cl)C(=O)C
|
|
983
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
984
|
CS(=O)(=O)NCc1ccccn1
|
|
985
|
c1(nnnn1O)c2nnnn2O
|
|
986
|
c1ccc(cc1)COc2c(nccn2)N
|
|
987
|
c1nc2n(n1)C(=O)CC(=N2)[O-]
|
|
988
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
989
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
990
|
c1(=O)c(nsnc1Cl)N
|
|
991
|
|
|
992
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
993
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
994
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
995
|
C1CCN(C1)c2c(=O)c(nsn2)Cl
|
|
996
|
|
|
997
|
c1cc(ncc1C#N)Sc2nccs2
|
|
998
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
999
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
1000
|
CCSc1nnc(o1)c2c(nc3n2ccs3)C
|
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