(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
2
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
3
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
4
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
5
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
6
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
7
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
8
|
Cc1cc(nc(n1)Nc2nc(on2)COc3ccccc3)C
|
|
9
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
10
|
|
|
11
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
12
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
13
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
14
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
15
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
16
|
Cc1c-2c(on1)CCc3c2n(nc3C(=O)[O-])C
|
|
17
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
18
|
c1ccc(cc1)c2nnn(n2)n3nc(nn3)c4ccccc4
|
|
19
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
20
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
21
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
22
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
23
|
c1cn(nc1n2cnnn2)C34CC5CC(C3)CC(C5)C4
|
|
24
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
25
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
26
|
c1cnc(nc1c2nccs2)N
|
|
27
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
28
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
29
|
c1ccc(cc1)c2nc(no2)c3nnc(o3)N
|
|
30
|
C1CCC(CC1)/C=C/C2NC(NC(N2)N)N
|
|
31
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
32
|
|
|
33
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
34
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
35
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
36
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
37
|
Cc1c(nc(nn1)N)/C=C/c2cc(cc3c2cccc3)O
|
|
38
|
c1ccc(cc1)c2ccncn2
|
|
39
|
|
|
40
|
c1ccc2c(c1)ncc(n2)c3cnc(nc3c4ccncc4)N
|
|
41
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
42
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
43
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
44
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
45
|
c1cc(oc1)c2ccnc(n2)N
|
|
46
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
47
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
48
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
49
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
50
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
51
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
52
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
53
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
54
|
Cc1nccc(n1)Sc2ccccc2
|
|
55
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
56
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
57
|
Cc1c(non1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)O[C@@H]3CO
|
|
58
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
59
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
60
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
61
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
62
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
63
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
64
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
65
|
|
|
66
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
67
|
[H]/N=c/n(cc(o1)c2ccc(cc2)CC)c3nc(cc(n3)C)C
|
|
68
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
69
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
70
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
71
|
c1cnc(c(n1)C(=O)[C@@H]2CCOC2)Cl
|
|
72
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
73
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
74
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
75
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
76
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
77
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
78
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
79
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
80
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
81
|
Cc1ccc(cc1)c2nnn(n2)c3c4c(c5ccccc5o4)ncn3
|
|
82
|
c1ccc(cc1)n2ccc(n2)Nc3nccc(n3)C(F)(F)F
|
|
83
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
84
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
85
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
86
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
87
|
Cc1cc(c(o1)C)c2cnnc(n2)N3CC[C@@H](C3)COC
|
|
88
|
Cc1nc(sn1)C2=CCCN(C2)C
|
|
89
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
90
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
91
|
c1cc(cc(c1)Cl)c2nnn(n2)c3ccc4nnnn4n3
|
|
92
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
93
|
Cc1nc(on1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
94
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
95
|
Cc1ccc(nc1)n2cnnn2
|
|
96
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
97
|
c1ccc(cc1)c2nccnn2
|
|
98
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
99
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
100
|
CN(C)C1CCC(CC1)/C=C/C2C3C(NCCN3)NC(N2)N
|
|
101
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
102
|
c1ccc(cc1)n2nc3ccc4c(c3n2)non4
|
|
103
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
104
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
105
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
106
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
107
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
108
|
c1cnc(cn1)c2nnc(o2)N
|
|
109
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
110
|
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
|
|
111
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
112
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
113
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
114
|
CC(C)Oc1cc(on1)c2[n-]nnn2
|
|
115
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
116
|
c1ccc(cc1)n2ncc(n2)c3[n-]nnn3
|
|
117
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
118
|
c1cc(nnc1n2cncn2)[O-]
|
|
119
|
c1cc(sc1)c2ccncn2
|
|
120
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
121
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
122
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
123
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
124
|
c1ccc(cc1)n2nc3ccc4c(c3n2)nc(cn4)N
|
|
125
|
CC1NC(ON1)C2CCC3C(C2)SCN3
|
|
126
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
127
|
Cc1ccc(cc1)n2cnc(=O)c(n2)C#N
|
|
128
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
129
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
130
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
131
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
132
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
133
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
134
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
135
|
|
|
136
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
137
|
CC1NC(ON1)C2CCCO2
|
|
138
|
CC1NCC2C(N1)N=C(NC2)C3CCC(CC3)CL
|
|
139
|
c1ccc(cc1)COc2c(non2)N
|
|
140
|
CCSc1ncnc(n1)N
|
|
141
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
142
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
143
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
144
|
c1ccc(cc1)COc2c(nccn2)N
|
|
145
|
c1([n-]nnn1)Nc2[n-]nnn2
|
|
146
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
147
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
148
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
149
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
150
|
|
|
151
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
152
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
153
|
c1ccc(cc1)c2c3c(non3)on2
|
|
154
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
155
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
156
|
c1ccnc(c1)c2cn(cn2)c3cccc(c3)C#N
|
|
157
|
CCOC(=O)N1CCN(CC1)C2NNC3NCCN3N2
|
|
158
|
c1ccc(cc1)c2nnn(n2)CCS(=O)(=O)N3CCOCC3
|
|
159
|
c1ccc(cc1)CNc2ncco2
|
|
160
|
c1ccc(cc1)n2cc(nn2)c3nc(on3)c4ccc5cc[nH]c5c4
|
|
161
|
c1cnc2c(n1)c(nnc2[O-])[O-]
|
|
162
|
Cc1c(non1)OCCOc2c(non2)C
|
|
163
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
164
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
165
|
Cc1c(non1)c2cn3cc(ccc3n2)Br
|
|
166
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
167
|
Cc1nc2c(ncnc2o1)N
|
|
168
|
Cc1cc(=O)n2c(n1)sc(n2)n3cnc(n3)C#N
|
|
169
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
170
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
171
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
172
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
173
|
c1cc(nnc1n2cnnn2)Cl
|
|
174
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
175
|
CC(C)(C)c1csc(n1)c2ccc(nc2)n3cncn3
|
|
176
|
Cc1c(nnc(c1c2[n-]nnn2)[O-])C
|
|
177
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
178
|
CC1NC(ON1)CC2CCCS2
|
|
179
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
180
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
181
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
182
|
Cc1ccc(cc1)c2nnc(o2)c3c(cnc(n3)SC)Cl
|
|
183
|
Cc1nc(n(n1)C(=O)c2cccs2)C
|
|
184
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
185
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
186
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
187
|
|
|
188
|
c1ccc(cc1)/C=C/c2ccncn2
|
|
189
|
c1cnccc1c2n[nH]c(=O)s2
|
|
190
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
191
|
c1ccc2c(c1)ncn2c3c(nc4nccn4n3)C(F)(F)F
|
|
192
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
193
|
COc1ccccc1n2ccnc(c2=O)N
|
|
194
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
195
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
196
|
Cn1cc(cn1)c2ccncn2
|
|
197
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
198
|
c1cncc(c1Sc2nnns2)S(=O)(=O)N
|
|
199
|
C1CC(CC(C1)BR)C2CN3CNSC3N2
|
|
200
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
201
|
C1CCC(CC1)Nc2nnns2
|
|
202
|
c1cc(oc1)/C=C/c2nn3cnnc3s2
|
|
203
|
Cn1c2c(cccn2)nc(c1=O)[NH+]3CCC[C@@H]3C(=O)[O-]
|
|
204
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
205
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)S2
|
|
206
|
Cn1cccc1CNc2[n-]nnn2
|
|
207
|
c1ccc(cc1)c2cnccn2
|
|
208
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
209
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
210
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
211
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
212
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
213
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
214
|
CCOC1NC(=O)N(S1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
215
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
216
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
217
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
218
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
219
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
220
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
221
|
Cc1ccc(cc1)c2ncns2
|
|
222
|
C[C@@]1(c2cccn2-c3ccccc3CO1)C(=O)[O-]
|
|
223
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
224
|
Cc1nc(on1)C2CN(C2)C(=O)C
|
|
225
|
Cn1c(nnn1)/N=C(/c2ccc(o2)Br)[O-]
|
|
226
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
227
|
c1c[nH]nc1c2nccs2
|
|
228
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
229
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
230
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
231
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
232
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
233
|
CC1CCC(N1N2C(NNN2)N)C
|
|
234
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
235
|
[H]/N=c/1onc(s1)c2c(non2)N
|
|
236
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
237
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
238
|
CCc1ccc(s1)Nc2ncnc(n2)Cl
|
|
239
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
240
|
Cn1c(nnn1)Sc2cccc(c2C#N)F
|
|
241
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
242
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
243
|
|
|
244
|
Cc1csc(n1)c2c(non2)N
|
|
245
|
c1c(c[nH]c1C(=O)[O-])S(=O)(=O)N
|
|
246
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
247
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
248
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
249
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
250
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
251
|
c1cc(sc1)c2c(non2)N
|
|
252
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
253
|
CN1C(=O)C(=C(C12CCCC2)N)C(=O)N
|
|
254
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
255
|
|
|
256
|
C1CCN(C1)S(=O)(=O)c2c(nc(nn2)[O-])[O-]
|
|
257
|
CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc2c(nccn2)N
|
|
258
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
259
|
c1ccn(c1)c2c(non2)N
|
|
260
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
261
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
262
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
263
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
264
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
265
|
CN(C)C(=O)Nc1n[n-]nn1
|
|
266
|
CC(C)(C)c1cnnc(n1)N
|
|
267
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
268
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
269
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
270
|
C=CCNC1CCNC(N1)N
|
|
271
|
c1ccn(c1)c2[n-]c(nn2)C(=O)[O-]
|
|
272
|
COC1NCCC(N1)SC
|
|
273
|
c1cc(nn2c1nnn2)n3ccnc3
|
|
274
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
275
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
276
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
277
|
Cc1c(cno1)c2csc(n2)C
|
|
278
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
279
|
C#CCCCNc1c(=O)n(cc(n1)Cl)c2ccccc2
|
|
280
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
281
|
c1cc(ccc1/N=C(/Nc2[n-]nnn2)O)Cl
|
|
282
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
283
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
284
|
C1CN2C(NC1=[NH2+])O[C@@H]3[C@H]2C[C@@H]([C@H]3O)CO
|
|
285
|
COc1cccc(n1)[C@H]2CCC(=O)NC2
|
|
286
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
287
|
c1cocc1c2nc(no2)C(=O)[O-]
|
|
288
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
289
|
Cc1cc(nc(n1)SC)C(=O)Nc2c(nsc2C)C
|
|
290
|
C1CCc2nn3c(n2CC1)c(c(nc3=O)SCC(=O)N)C#N
|
|
291
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
292
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
293
|
CC1NC(NO1)C2(CCCC2)NC(=O)C
|
|
294
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
295
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
296
|
c1ccc(cc1)c2nncnn2
|
|
297
|
Cc1c(c2nnc3c(=O)[nH]oc3n2n1)c4ccccc4
|
|
298
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
299
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
300
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
301
|
Cc1nc(on1)CNS(=O)(=O)C
|
|
302
|
c1ccc(cc1)c2ncc(o2)c3ncco3
|
|
303
|
|
|
304
|
CS(=O)(=O)NCc1ccccn1
|
|
305
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
306
|
Cc1cnc(nc1c2ncnn2C)N
|
|
307
|
c1nc([nH]n1)c2c(non2)N
|
|
308
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
309
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
310
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
311
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
312
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
313
|
COc1ccc(cc1OC)/C=C/c2nc(on2)c3ccccc3O
|
|
314
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
315
|
Cn1c(ncn1)C(=O)C2CC2
|
|
316
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
317
|
Cc1c(cc2c(n1)nc(o2)[O-])c3ccncc3
|
|
318
|
Cn1cc(cn1)c2cnccn2
|
|
319
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
320
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
321
|
C[C@@H]1C(=O)N=C(N1c2nc(nc(n2)OC)NC(C)C)N
|
|
322
|
COc1cccc(c1)C2=CCN(CC2)Cn3cnc(n3)C(=O)OC
|
|
323
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
324
|
c1ccc(cc1)Nc2nc(ns2)N
|
|
325
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
326
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
327
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
328
|
CC1NC(ON1)C2CNCCN2
|
|
329
|
C1CCC(CC1)S(=O)(=O)OC2CCC(NN2)[O-]
|
|
330
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
331
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
332
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
333
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
334
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
335
|
C1CC(C1)c2nc(no2)CO
|
|
336
|
c1(c(non1)N)c2nnc(o2)N
|
|
337
|
Cn1cc(nc1C(=O)[O-])NC(=O)c2cccs2
|
|
338
|
CC1=C(C(=O)NC2=NNC(=O)[C@@H]12)CCC(=O)[O-]
|
|
339
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
340
|
Cc1c(non1)NCNc2c(non2)C
|
|
341
|
Cc1nc(c(o1)n2cnc3c2cccc3)C#N
|
|
342
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
343
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
344
|
c1cnnc(n1)c2nccnn2
|
|
345
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
346
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
347
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
348
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
349
|
Cc1c(oc(n1)NS(=O)(=O)c2ccc(cc2)N)C
|
|
350
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
351
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
352
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
353
|
Cc1ccc(c(n1)N)Cn2c(c(sc2=O)CCO)C
|
|
354
|
CC(=O)NC1NCNC(N1)N
|
|
355
|
c1ccc(cc1)Oc2c(non2)N
|
|
356
|
C1Cc2c(nc(nc2c3c4c(nc(n3)N)CCC4)N)C1
|
|
357
|
CC(=O)Nc1nc(cs1)Cn2c(noc2=O)c3ccccc3
|
|
358
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
359
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
360
|
CCC(=O)Nc1nnn(n1)C
|
|
361
|
CCCCSc1nc(c2nc3ccccc3c(=O)n2n1)[O-]
|
|
362
|
Cc1cc(ncn1)Nc2ccccc2
|
|
363
|
Cn1c(nc(n1)Br)n2ccnc2
|
|
364
|
CCOC(=O)Cn1nc(nn1)CSc2ccc(cc2)Cl
|
|
365
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
366
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
367
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
368
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
369
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
370
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
371
|
c1ccc(cc1)Nn2cncn2
|
|
372
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
373
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
374
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
375
|
CC1(CCc2c(ccc3c2cc(o3)c4ccccn4)O1)C
|
|
376
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
377
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
378
|
c1ccc(cc1)SCn2cncn2
|
|
379
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
380
|
c1cnccc1c2nnc3n2CCC3
|
|
381
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
382
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
383
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
384
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
385
|
c1ccc(cc1)C2=Nc3c(non3)NC=C2
|
|
386
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
387
|
c1cc(sc1)Cc2[n-]nnn2
|
|
388
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
389
|
CC(=O)NC1=N[C@@]2([C@@H](c3ccccc3[C@@]2(N1)O)O)O
|
|
390
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
391
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
392
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
393
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
394
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
395
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
396
|
CC1NC(ON1)[C@@H]2CCC=CC2
|
|
397
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
398
|
c1cc(oc1)C(=O)c2cn(nn2)c3ccc(c(c3)Cl)Cl
|
|
399
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
400
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
401
|
c1ccc2c(c1)c3c(cc(s3)C(=O)[O-])c(=O)o2
|
|
402
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
403
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
404
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
405
|
CCOC(=O)[C@@H]1[C@@H](NC(=NC1=O)C)c2ccco2
|
|
406
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
407
|
Cc1c(snn1)c2cc(nc(n2)SC)[O-]
|
|
408
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
409
|
C[C@@H]1NC(=O)c2ccccc2O1
|
|
410
|
Cc1cc(c(c(=O)o1)[C@@H]2c3ccccc3C(=O)O2)O
|
|
411
|
c1cc(sc1)c2[n-]nnn2
|
|
412
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
413
|
Cc1nc(no1)c2ncon2
|
|
414
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
415
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
416
|
c1cnccc1c2ccnc3n2ncc3
|
|
417
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
418
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
419
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
420
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
421
|
c1nc(c2n1CC(=O)NC2)C(=O)N
|
|
422
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
423
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
424
|
Cc1c(non1)c2cc3ccccn3c2
|
|
425
|
c1cc(ncc1C#N)NCc2nccs2
|
|
426
|
Cc1n[nH]/c(=NC(=O)CCC(=O)NC2CCCCC2)/s1
|
|
427
|
c1ccc(cc1)c2nc(sn2)n3ccc(n3)C(F)(F)F
|
|
428
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
429
|
CC(C)(C)OC(=O)N1CCn2c(nnc2C(=O)[O-])C1
|
|
430
|
c1cc(oc1)c2nc([nH]n2)N
|
|
431
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
432
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
433
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
434
|
c1nnn(n1)C[C@@H]2CCOCO2
|
|
435
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
436
|
COc1nc(cnn1)c2cnnc(n2)OC
|
|
437
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
438
|
|
|
439
|
c1ccc(cc1)c2nnc(s2)Oc3ccc4ccc(=O)oc4c3
|
|
440
|
c1c(cc2c3c1occ3CC(=O)O2)O
|
|
441
|
c1cc(oc1)CNc2[n-]nnn2
|
|
442
|
Cc1nnc(o1)CSc2ccccn2
|
|
443
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
444
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
445
|
c1cn(cn1)c2nc(nc(n2)Cl)N3CCCCC3
|
|
446
|
|
|
447
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
448
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
449
|
c1ccc(cc1)c2nc(cc(=O)o2)[O-]
|
|
450
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
451
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
452
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
453
|
C(c1c(non1)N)c2c(non2)N
|
|
454
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3c(=O)ccc(n3)c4ccco4
|
|
455
|
CCOC(=O)c1ccc(cc1)n2c(=O)oc(n2)C
|
|
456
|
COC(=O)Nc1cn2ccccc2n1
|
|
457
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
458
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
459
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
460
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
461
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
462
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
463
|
CC1([C@@H]2CC(=O)CCCN2C(=O)N1)C
|
|
464
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
465
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
466
|
C(CS(=O)(=O)c1c(c(nc(c1Cl)F)F)F)O
|
|
467
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
468
|
c1ccc2c(c1)cc(c(=O)o2)C(=O)n3cccn3
|
|
469
|
C=CCNc1nc(ns1)N
|
|
470
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
471
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
472
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
473
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
474
|
C=CCOC1CCNC(N1)N
|
|
475
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
476
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
477
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
478
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
479
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
480
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
481
|
Cc1ccc(cc1)c2cnon2
|
|
482
|
Cc1c(non1)c2ccn[nH]2
|
|
483
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
484
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
485
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
486
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
487
|
Cc1c(non1)COc2ccc(cc2)C(=O)[O-]
|
|
488
|
c1cnc(cn1)NC23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
489
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
490
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
491
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
492
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
493
|
c1ccc(cc1)NC(=O)c2ccccn2
|
|
494
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2[nH]nc3
|
|
495
|
CC1=CC(=C(O[C@@H]1c2cccnc2)C)C(=O)OC
|
|
496
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
497
|
|
|
498
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
499
|
Cc1ccc(n1c2[n-]c(nn2)SCCCC(=O)[O-])C
|
|
500
|
CC1C(NN(N1)C(=O)OC)N(C)C
|
|
501
|
Cn1cc(ccc1=O)c2nnc(o2)c3cc4c(s3)CCC4
|
|
502
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
503
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
504
|
c1cc(c(cc1S(=O)(=O)[O-])C(=O)[O-])c2cn[nH]c2[O-]
|
|
505
|
Cc1c(nccn1)c2ccn[nH]2
|
|
506
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
507
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
508
|
Cc1nc([nH]n1)/N=C(/N2CCc3cc(c(cc3C2)OC)OC)[O-]
|
|
509
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
510
|
C1CNC(NC1C(F)(F)F)N2CCNC2
|
|
511
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
512
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
513
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
514
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
515
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
516
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
517
|
c1ccc(cc1)CNc2c(non2)O
|
|
518
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
519
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
520
|
Cc1c(cc(c(n1)C)C(=O)C)c2ccnc(n2)N3CCCC3
|
|
521
|
C1COCCN1C2C(=O)NC(SN2)N
|
|
522
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
523
|
CC(=O)NC1CCC2C(C1)NCNN2
|
|
524
|
Cc1cc(c(c(=O)n1c2nnns2)C(=O)C)[O-]
|
|
525
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
526
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
527
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
528
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
529
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
530
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
531
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
532
|
c1c(nc(cn1)Cl)n2cncn2
|
|
533
|
c1cc2c(cc1C(F)(F)F)nc(s2)c3csnn3
|
|
534
|
c1ccc(cc1)c2nc(on2)c3csnn3
|
|
535
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
536
|
C[C@@H](C(=O)C1=N[C@@H]2C(=[NH+]C1)NC(=NC2=O)[NH-])[O-]
|
|
537
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
538
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
539
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
540
|
Cc1c2cc3c(nc2n(n1)C)C(=O)OCC3
|
|
541
|
CS(=O)(=O)c1ccc2c(c1CCC(=O)[O-])O2
|
|
542
|
Cc1nc(no1)c2cccs2
|
|
543
|
c1cnn(c1)CCSc2nncs2
|
|
544
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
545
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
546
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
547
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
548
|
Cc1nc(no1)c2cccc(c2)S(=O)(=O)NCC(=O)[O-]
|
|
549
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
550
|
CCc1nc(cs1)CSc2nccn2C
|
|
551
|
C[C@@H]1[C@@H](C(=O)OC1(C)C)c2[n-]nnn2
|
|
552
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
553
|
Cn1cnn2c1nc(c2)c3ccccc3
|
|
554
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
555
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
556
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
557
|
c1cc(sc1)c2c(n[n-]n2)C#N
|
|
558
|
Cc1cc(no1)c2nc(on2)C(C)(C)C
|
|
559
|
CC[C@@]1(C(=O)NC(=N1)c2c(cccn2)C(=O)[O-])C
|
|
560
|
Cc1nnc(o1)Nc2ccccc2
|
|
561
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
562
|
C1[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](N2S(=O)(=O)N1)O)O)O)O
|
|
563
|
Cn1c(nnn1)SCc2cnc(s2)c3ccccc3
|
|
564
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
565
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
566
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
567
|
c1cnoc1c2nnc(o2)N
|
|
568
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
569
|
|
|
570
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
571
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
572
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
573
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
574
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
575
|
c1ccc(cc1)c2cc(no2)c3c(non3)N
|
|
576
|
c1cnc(c(n1)C#N)n2ccnc2
|
|
577
|
CC(C)(C)OC(=O)N1CCC(=CC1)c2ccccn2
|
|
578
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
579
|
Cc1c(c(on1)C)n2c(=O)n(c(=O)s2)CC3CC3
|
|
580
|
COc1c2c([nH]n1)nncn2
|
|
581
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
582
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
583
|
Cc1nnc2n1nc(n2c3ccccc3)[O-]
|
|
584
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
585
|
C(C#N)c1nc(nc(n1)N)N
|
|
586
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
587
|
CC(C)(C)C(=O)OCSc1nc(no1)c2cccnc2
|
|
588
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
589
|
[H]/N=C/NC(=C2[C@@H]([C@@H](C(=O)N=C2N1)C#N)c3ccccc3)[O-]
|
|
590
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
591
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
592
|
Cc1nc2ccc(cc2s1)n3c(c(nn3)[O-])C#N
|
|
593
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
594
|
CC(=O)c1cc2cnccc2[nH]c1=O
|
|
595
|
Cc1nc-2n(n1)C=COc3c2cccc3
|
|
596
|
Cc1cc(c(o1)C)c2csc(n2)NC(=O)C
|
|
597
|
|
|
598
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
599
|
Cc1ccc(cc1)c2nc(no2)n3c4ccccc4nn3
|
|
600
|
Cc1csc(n1)Cc2nc(no2)c3ccc(cc3)O
|
|
601
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
602
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
603
|
|
|
604
|
CCSc1cc(ncn1)N
|
|
605
|
Cc1cnc(o1)COc2ccccc2
|
|
606
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
607
|
CC1NNC(O1)NC(=O)C2CCC(CC2)C#N
|
|
608
|
Cc1[nH]nc(n1)c2ccccc2
|
|
609
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
610
|
Cc1nnc(c2n1c3ccoc3c2)[O-]
|
|
611
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
612
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
613
|
Cnccs/c1=NC(=O)CNS(=O)(=O)c2cnn(c2)C
|
|
614
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
615
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
616
|
C1CCc2c(c3c(c([nH]c3s2)C#N)N)C1
|
|
617
|
CC1=NC2=NC(=NC(=O)C2=C1Sc3ccccn3)[NH-]
|
|
618
|
c1c([nH]nn1)SCC(=O)N
|
|
619
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
620
|
Cc1c2c(nc3ccccc3n2)n(n1)c4nccs4
|
|
621
|
c1cc(oc1c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4)[C@@H]5CCCCO5
|
|
622
|
c1ccc(cc1)c2cc3nc(c4c(n3n2)nc(o4)c5ccccc5)N
|
|
623
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
624
|
c1cnccc1c2cc3n(n2)CCNC3=O
|
|
625
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
626
|
CN1C(NCN1)CCC2CCCCC2
|
|
627
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
628
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
629
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
630
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
631
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
632
|
COc1c2c(ncn1)Sc3c(ncnc3OC)N2
|
|
633
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
634
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
635
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
636
|
CCCn1c2=N[C@@H](C(=c2c(=O)[nH]c1=O)[O-])C
|
|
637
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
638
|
Cc1c(=O)nc2n(n1)cnc3n2nc(c3)c4ccccc4
|
|
639
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
640
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
641
|
|
|
642
|
Cc1c(c(n[nH]1)O)[C@@H]2c3ccccc3C(=O)O2
|
|
643
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
644
|
Cc1ccc(n1c2cnccn2)C
|
|
645
|
c1ccc2c(c1)c(=O)c(=N[C@@H]3[C@@H](c4ccccc4C3=O)O)c2=O
|
|
646
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
647
|
c1cc(oc1)c2cc(on2)N
|
|
648
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
649
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
650
|
Cc1c(c(sn1)C)Nc2c(c(ncn2)SC)C#N
|
|
651
|
|
|
652
|
Cc1c(sc(n1)NC(=O)C)c2nc(no2)c3ccccc3
|
|
653
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
654
|
CC(=O)Oc1ccc(nn1)[O-]
|
|
655
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
656
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
657
|
[H]/N=c/n(nc(s1)C(=O)C)c2ccccc2
|
|
658
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
659
|
c1csc(n1)n2cnnn2
|
|
660
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
661
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
662
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
663
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
664
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
665
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
666
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
667
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
668
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
669
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
670
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
671
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
672
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
673
|
c1cnccc1c2nc3n(n2)CCC3
|
|
674
|
CC(C)(C)OC(=O)N1CCC(CC1)Cc2cnc[nH]2
|
|
675
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
676
|
c1ccc2c(c1)CCNC(=O)C(=O)N2
|
|
677
|
c1cc(oc1)c2nc(on2)CO
|
|
678
|
CC1=C(CC(=O)N1Cc2ccco2)C(=O)OC
|
|
679
|
CC1NC(C(O1)C(C)C)N(C(C)C)C(C)C
|
|
680
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
681
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
682
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
683
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
684
|
c1ccc(cc1)S(=O)(=O)C[C@@H]2CSc3n2ncn3
|
|
685
|
c1ccc(cc1)c2nc(on2)c3c(n(nn3)c4ccccc4)N
|
|
686
|
C[C@@H]1CCC2C(C(=O)[NH]C(N2)N)N1
|
|
687
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
688
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
689
|
CCOC(=O)C1=CNc2ccccc2N=C1N
|
|
690
|
C1CCC(CC1)C(=O)N[C@@H]2C(=O)NN=C2[O-]
|
|
691
|
C1CCN(C1)c2c(non2)[O-]
|
|
692
|
C1CNC(=O)[C@@H]2[C@H]1CNC2=O
|
|
693
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
694
|
c1ccc(cc1)C#CNCCOc2ccccn2
|
|
695
|
CC1CC2CC3CCCNN3C2NN1
|
|
696
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
697
|
c1cc(oc1)CN2C3=NC(=O)[C@@](C3=C(NC2=O)[O-])(C(F)(F)F)O
|
|
698
|
Cc1c(cn(n1)C(=O)C)c2nc(sn2)Nc3ccccc3
|
|
699
|
Cc1c(non1)[C@@H]2CCCN2C(=O)c3ccnc(c3)NC
|
|
700
|
c1cnccc1c2cnc3cc(nn3c2)O
|
|
701
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
702
|
COC(=O)CCc1c[nH]cn1
|
|
703
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
704
|
COc1cc(=O)nc(o1)c2ccco2
|
|
705
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
706
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
707
|
Cc1cc(n2c(n1)ncn2)n3ccnc3
|
|
708
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
709
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
710
|
c1ccc(cc1)C(=O)c2ncco2
|
|
711
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
712
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
713
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
714
|
Cc1cc2nc(cc(=O)n2o1)N(C)Cc3ccsc3
|
|
715
|
c1ccc2c(c1)nn(n2)c3cc(n[nH]3)O
|
|
716
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
717
|
|
|
718
|
CC1=C(Oc2ccccc2O1)c3ccccn3
|
|
719
|
Cc1c(non1)NCn2cnnn2
|
|
720
|
C1=CC2=NNC(=O)[C@@H]2C=C1C(=O)[O-]
|
|
721
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
722
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
723
|
CCC(=O)Cc1cnccn1
|
|
724
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
725
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
726
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
727
|
C1CC2C3C(C(NNN3)[O-])SC2NC1
|
|
728
|
COC(=O)c1cc2c(s1)c(n[nH]2)N
|
|
729
|
Cc1cc(no1)c2cc(=O)[nH]c(n2)SC
|
|
730
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
731
|
c1cn(nc1CC(C(F)(F)F)(C(F)(F)F)O)C(=O)N
|
|
732
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
733
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
734
|
Cc1nnnn1[C@@H]2CC(=O)[C@H]3OC[C@@H]2O3
|
|
735
|
CCC(=O)N1CCC(CC1)(c2c(nc(cn2)OC)OC)O
|
|
736
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
737
|
CC(C)(C)c1cc2n(n1)C3=NCCN3C=N2
|
|
738
|
CC1NC2C(NCNC2NN1)N
|
|
739
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
740
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
741
|
c1ccc2c(c1)c3ccc(cc3o2)n4ncnn4
|
|
742
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
743
|
Cn1c(ccn1)C(=O)Nn2cnnc2
|
|
744
|
C1COC(N1)NC2CCCCC2
|
|
745
|
CSC1NCCC(N1)C#N
|
|
746
|
CCOC(=O)c1nccnn1
|
|
747
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
748
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
749
|
Cc1nc(on1)c2c(non2)N
|
|
750
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
751
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
752
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
753
|
c1ccc(cc1)Cn2cnnn2
|
|
754
|
CN(CC(=O)[O-])c1ncc2c(n1)C=CCC2
|
|
755
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
756
|
CNc1nc(ns1)C23CC4CC(C2)CC(C4)C3
|
|
757
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
758
|
Cc1nc(c(o1)NCCc2nc(no2)c3ccccc3)C#N
|
|
759
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
760
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
761
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
762
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
763
|
|
|
764
|
CCOC(=O)c1cc(c(o1)N)[C@@](C(=O)OC)(C(F)(F)F)O
|
|
765
|
c1cc(sc1)Sc2nc(ns2)Cl
|
|
766
|
c1ccnc(c1)SCc2ccco2
|
|
767
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
768
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
769
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
770
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
771
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
772
|
CN(C)c1nnnn1c2cccnc2
|
|
773
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
774
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
775
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
776
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
777
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
778
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
779
|
CC1NC(ON1)C2CCCS2
|
|
780
|
Cc1c(c(n(n1)C)n2cncn2)N
|
|
781
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
782
|
c12c(nnnc1snn2)O
|
|
783
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
784
|
CN(C)c1nc(sc(=O)n1)N(C)C
|
|
785
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
786
|
c1cc(cc(c1)Cl)n2ccc(n2)c3cnccn3
|
|
787
|
C1CC2C(NC1)SC3CNNCC3N2
|
|
788
|
CCO[C@@H](C=C)n1cncn1
|
|
789
|
Cc1ncc(s1)CN(C)Cn2c(=O)oc(n2)c3ccccc3
|
|
790
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
791
|
Cc1cc(nn2c1nnc2)n3ccnc3
|
|
792
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
793
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
794
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
795
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
796
|
CC[C@@H](c1cnn(c1)C)NC(=O)c2c(ocn2)C
|
|
797
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
798
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
799
|
Cc1cc(nc(n1)Nc2[nH]ncn2)C
|
|
800
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
801
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
802
|
c1c(nc[nH]1)C[C@@H]2C(=O)N3CCC[C@@H]3C(=O)N2
|
|
803
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
804
|
c1ccc(cc1)CCc2cnccn2
|
|
805
|
Cc1cnc(o1)Cn2cccn2
|
|
806
|
c1csc2c1c(n[nH]c2=O)N
|
|
807
|
c1cc(oc1)Cn2c(=O)c3cnc(nc3nc2[O-])n4ccnc4
|
|
808
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
809
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
810
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
811
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
812
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
813
|
c1cc(oc1)CSc2ccc(cc2)n3cnnn3
|
|
814
|
CS(=O)(=O)Nc1ccccn1
|
|
815
|
c1c2cc(nc(c2c(nc1O)O)O)O
|
|
816
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
817
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
818
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
819
|
Cc1c(cc2c(c(sc2n1)c3nnc(o3)C)N)C(=O)C
|
|
820
|
C1C(=O)CC2NN[NH]N2C1N
|
|
821
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
822
|
Cc1nc(on1)CN2CCSc3c2cccc3
|
|
823
|
Cc1csc(n1)Sc2nc(ns2)Cl
|
|
824
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
825
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
826
|
|
|
827
|
c1cnc(nc1)Sc2cnnc(c2Cl)[O-]
|
|
828
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
829
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
830
|
|
|
831
|
Cn1c(c(cn1)c2nc(no2)C3CC3)N
|
|
832
|
c1cc(cnc1)c2cc3c(ncnc3o2)NC(=O)C4CC4
|
|
833
|
C1=C(C=C([C@H]2C1=NC=N2)N)C(=O)[O-]
|
|
834
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
835
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
836
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
837
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
838
|
c1nc(c(n1Cc2n[n-]nn2)Cl)Cl
|
|
839
|
c1ncn(n1)CCn2cncn2
|
|
840
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
841
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
842
|
CC(=O)/N=c/c(nn(s1)C(=O)C)C(=O)N
|
|
843
|
CCc1nnc(c2n1ccc2)N3CCC(CC3)C(=O)[O-]
|
|
844
|
CC=NC(=O)[C@@](/C1=C(/[O-])OC)(C(F)(F)F)Nc2ncccn2
|
|
845
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
846
|
c1cnccc1c2nnn(n2)CC#N
|
|
847
|
C1=C[C@@]2([C@@H]3[C@@H]([C@H]1O2)C(=NC3=O)[O-])CO
|
|
848
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
849
|
COC1=C[C@@H]([C@@](C=C1OC)(c2ncccn2)OC)C(=O)N
|
|
850
|
CC[C@@H](CCC(=O)/N=c/ccn([nH]1)c2ccccc2)C(=O)[O-]
|
|
851
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
852
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
853
|
c1ccnc(c1)C2=CCCCC2
|
|
854
|
|
|
855
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
856
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
857
|
CCOC(=O)c1nc(on1)C
|
|
858
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
859
|
c1c2cc(oc2ncc1F)CO
|
|
860
|
CC1C(NON1)C(=O)N(C)C
|
|
861
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
862
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
863
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
864
|
c1cc(sc1)CCNc2ncccn2
|
|
865
|
c1ccc(cc1)[C@@H]2C(=O)NC(=O)O2
|
|
866
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
867
|
Cc1cc(=O)n2c(n1)sc(n2)Sc3ncnn3N
|
|
868
|
Cc1cc(no1)Cn2cnc(n2)C#N
|
|
869
|
Cc1c(snn1)c2nnc3n2CCC3
|
|
870
|
C1CC(NNC1)/C=C/C2CCCO2
|
|
871
|
Cc1nnn(n1)Cc2nnnn2C
|
|
872
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
873
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
874
|
c1c(c(n2c(n1)ncn2)[O-])n3cncn3
|
|
875
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
876
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
877
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
878
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
879
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
880
|
C1CNNCC1CCC(=O)[O-]
|
|
881
|
CCNC(=O)Oc1c2ccccc2on1
|
|
882
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
883
|
CS(=O)(=O)c1nc(on1)N
|
|
884
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
885
|
|
|
886
|
CCCO[C@@H]1CCCN(C1)C(=O)c2ccnnc2
|
|
887
|
Cn1c2c(cn1)nc([nH]2)c3ccccc3
|
|
888
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
889
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
890
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
891
|
CC[C@@H]1C2=C(CN(C2=O)CC(=O)[O-])NC(=O)N1
|
|
892
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
893
|
|
|
894
|
Cc1nnnn1c2cc3c(s2)CCCC3
|
|
895
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
896
|
C1CCC(CC1)C2C3C4C(CCCN4C(=O)N2)CCC3
|
|
897
|
c1ccc-2c(c1)CCc3c2nc4c(n3)c(ncn4)O
|
|
898
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
899
|
CCOC(=O)Cc1[nH]ncn1
|
|
900
|
Cc1cc(n(n1)CCc2nc(on2)c3ccccc3)C
|
|
901
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
902
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
903
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
904
|
Cc1c(nn(n1)c2ccccc2)C(=O)n3cccc3
|
|
905
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
906
|
CCOC(=O)C1=C(Oc2ccccc2NC1=O)N
|
|
907
|
C1Cc2nnc(n2C1)C(=O)[O-]
|
|
908
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
909
|
CN1NC(NN1)C2[N-]NNN2
|
|
910
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
911
|
c1cc(sc1)c2cnco2
|
|
912
|
CCOc1nc(sn1)OCC
|
|
913
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
914
|
Cc1c2c([nH]n1)OC(=C([C@@H]2c3ccco3)C(=O)N)N
|
|
915
|
CC1CC(N(N1)C2=NS(=O)(=O)C3CCCCC3N2C)C
|
|
916
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
917
|
c1cc(c(nc1)n2cncn2)N
|
|
918
|
CSc1ccc(cc1)c2nc(on2)c3ccc[nH]c3=O
|
|
919
|
c1ncn(n1)C[C@@H]2COC3(O2)CCCCC3
|
|
920
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
921
|
Cc1ccc(cc1)NC(=O)c2nnc(s2)Cn3ccnc3
|
|
922
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
923
|
Cc1c(c(c([nH]1)C)C(=O)[O-])c2nnc(o2)C
|
|
924
|
C=Cc1nc(cs1)C(=O)[O-]
|
|
925
|
Cc1nnc(o1)CSc2nccn2C
|
|
926
|
C1CCC2C(C1)NS(=O)(=O)CCO2
|
|
927
|
C1C[C@@H]2N=Cc3c(c(sc3N2C1)C(=O)N)N
|
|
928
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
929
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
930
|
C1[C@@H]([C@H](O[C@H]1[C@@H]2C=CC=NC2=O)CO)O
|
|
931
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
932
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
933
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
934
|
Cc1ccnn1CC/N=c/c(=N/CCCOC)/c(c2O)O
|
|
935
|
|
|
936
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
937
|
Cc1nc(cs1)[C@@H]2COc3ccccc3O2
|
|
938
|
Cc1c(c(on1)C)Nc2c(c(ncn2)SC)C#N
|
|
939
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
940
|
c1ccc(cc1)CN2CCNS2(=O)=O
|
|
941
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
942
|
COC(=O)c1cc(=O)nc(s1)N
|
|
943
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
944
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
945
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
946
|
c1cc2c(c(c1)F)ncnc2n3ccnc3
|
|
947
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
948
|
Cc1c2c(c(cn1)N)COC(O2)(C)C
|
|
949
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
950
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
951
|
CCc1cccc([o+]1)c2ccccc2
|
|
952
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
953
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
954
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
955
|
Cc1nnnn1C2CCCCC2
|
|
956
|
COc1nc(nc(n1)OC)C(=O)c2ccccc2
|
|
957
|
|
|
958
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
959
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
960
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
961
|
CC1(Cc2c(nc(c(n2)N)C(=O)OC)CO1)C
|
|
962
|
Cc1nc(cs1)/C=C/c2cccnc2
|
|
963
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
964
|
C1N=C(N=C2N1[C@H]3[C@@H](O2)[C@@H]([C@@H](O3)CO)O)N
|
|
965
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
966
|
c1ccc2c(c1)C(=O)c3nccn3C2=O
|
|
967
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
968
|
COC(=O)Nc1cn2c(n1)ccc(n2)C(=O)N
|
|
969
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
970
|
COC(=O)Nc1/c(=N/C(=O)OC)/n(on1)[O-]
|
|
971
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
972
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
973
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
974
|
CN(C)S(=O)(=O)[N-]c1nc(nc(n1)Cl)Cl
|
|
975
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
976
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
977
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
978
|
Cc1cc(=O)n2c(csc2c1C#N)C
|
|
979
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
980
|
|
|
981
|
C[C@@H](c1nc2ccccc2o1)n3c4ccccc4nn3
|
|
982
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
983
|
Cc1c(cn(n1)c2ccccn2)N3C[C@@H](CC3=O)C(=O)[O-]
|
|
984
|
c1(nnc(o1)[O-])C(F)(F)F
|
|
985
|
Cc1cc(=O)[nH]c(n1)C2CC2
|
|
986
|
|
|
987
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
988
|
c1cc(ccc1c2c(c[nH]n2)N3C=CCCC3=O)Cl
|
|
989
|
COc1cc(nc(c1)C(=O)Nc2[n-]nnn2)c3ccc(cc3)N
|
|
990
|
CCOC(=O)N=[S@@](=O)(c1ccccc1)N
|
|
991
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
992
|
c1ncn(n1)NCNn2cncn2
|
|
993
|
Cc1cc(no1)NS(=O)(=O)C
|
|
994
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
995
|
Cc1c(n2c(ncn2)nn1)[O-]
|
|
996
|
Cc1nnc(o1)[C@H]2CCN(C2)C(=O)C
|
|
997
|
CS(=O)(=O)/N=C(/c1ccc(nc1)C(=O)[O-])[O-]
|
|
998
|
c1ccc2c(c1)[C@@H]3[C@H]4C3C(=O)NC2c5c4cccc5
|
|
999
|
C1CCC2(C1)NC(CO2)(CO)CO
|
|
1000
|
Cc1c(cco1)c2nnc(o2)N
|
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