(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
2
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
3
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
4
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
5
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
6
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
7
|
Cc1c2ccccc2nc(c1C(=O)[O-])Cn3cccn3
|
|
8
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
9
|
c1cnc(nc1c2nccs2)N
|
|
10
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
11
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
12
|
Cc1nc2ccccc2c(=O)n1c3nc[nH]n3
|
|
13
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
14
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
15
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
16
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
17
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
18
|
C1CCC(CC1)C(=O)NN2CCNN2
|
|
19
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
20
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
21
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
22
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
23
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
24
|
Cc1ccc(cc1)Sc2c(cccn2)n3cccc3
|
|
25
|
c1ccnc(c1)N[C@@H]2C[C@@H]3[C@H](O2)[C@@H](CO3)O
|
|
26
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
27
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
28
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
29
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
30
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
31
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
32
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
33
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
34
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
35
|
c1ccnc(c1)CCSc2nncs2
|
|
36
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
37
|
Cc1cc(c(c(=O)n1c2nnns2)C(=O)C)[O-]
|
|
38
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
39
|
C1NC([NH]N1)NC2=NCCO2
|
|
40
|
|
|
41
|
CCNC(=O)Oc1c2ccccc2on1
|
|
42
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
43
|
Cc1c(=O)nc([nH]n1)c2cccs2
|
|
44
|
Cc1c(nnn1c2nccs2)C(=O)[O-]
|
|
45
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
46
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
47
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
48
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
49
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
50
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
51
|
CCN1CCc2c(c([nH]c(=O)c2C#N)[O-])C1
|
|
52
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
53
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
54
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
55
|
C1CCC(CC1)COC(=O)N[C@@H](CC(=O)N)C2[N-]NNN2
|
|
56
|
c1c2c(nc(nc2oc1C(=O)[O-])C(F)(F)F)[O-]
|
|
57
|
CNC(=O)NCNC(=O)NC
|
|
58
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
59
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
60
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
61
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
62
|
c1ccc(cc1)n2c(nnc2[O-])c3cccnc3
|
|
63
|
CC(C)NC(=O)c1ccc(o1)c2cncnc2
|
|
64
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
65
|
Cn1c(ccn1)C(=O)Nn2cnnc2
|
|
66
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
67
|
c1cnnc(n1)c2nccnn2
|
|
68
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
69
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
70
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
71
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
72
|
COCCN1C2C(C(NC(N2)N)N)N=C3C1=CCCC3
|
|
73
|
c1cc2c(nc1)Nc3c(c(=O)nc([nH]3)N)S2
|
|
74
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
75
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
76
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
77
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
78
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
79
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
80
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
81
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
82
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
83
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
84
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
85
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
86
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
87
|
|
|
88
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
89
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
90
|
CC1C(OC(N1)NC(=O)N(C)C2CC2)C
|
|
91
|
CCNC(=O)[C@@H](C)n1cnnc1C#N
|
|
92
|
c1ccc2c(c1)C(=NS2(=O)=O)n3ccnc3
|
|
93
|
CSc1nc(c(nn1)c2ccco2)c3ccco3
|
|
94
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
95
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
96
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
97
|
c1c2c(nc(n1)N)CCCC2=O
|
|
98
|
Cc1cc([nH]n1)OCCC#N
|
|
99
|
CN1CNNC1CNS(=O)(=O)N2CCCCC2
|
|
100
|
|
|
101
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
102
|
C1CCC2C(C1)[C@@H](CCS2)NC3CNCC(N3)CL
|
|
103
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
104
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
105
|
CS(=O)(=O)NCc1ccccn1
|
|
106
|
c1cc2c(nc1)Nc3c(cccn3)O2
|
|
107
|
c1ccc(cc1)CNc2cnccn2
|
|
108
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
109
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
110
|
CCCCn1c(nnn1)NC(=O)N(C)Cc2nc(no2)CC
|
|
111
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
112
|
Cc1cc2nc(cc(=O)n2o1)Cl
|
|
113
|
c1cc(nnc1n2cncn2)[O-]
|
|
114
|
|
|
115
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
116
|
c1ccc2c(c1)c3c([nH]2)nc4c(n3)non4
|
|
117
|
C(CF)NC(=O)NCCF
|
|
118
|
Cc1nnc(s1)SCSc2ccccn2
|
|
119
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
120
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
121
|
CCOc1nnc(s1)Cn2c(noc2=O)c3ccccc3
|
|
122
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
123
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
124
|
CC1CC2CC3CCCNN3C2NN1
|
|
125
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
126
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
127
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
128
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
129
|
|
|
130
|
CC(=O)OC1C2C(C(NN1)[O-])SCCS2
|
|
131
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
132
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
133
|
Cc1c(n2c(ncn2)nn1)[O-]
|
|
134
|
|
|
135
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
136
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
137
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
138
|
[H]/N=c/n(nc(s1)Br)CC=C
|
|
139
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
140
|
CC(=O)N(C)c1cccnc1
|
|
141
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
142
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
143
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
144
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
145
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
146
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
147
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
148
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
149
|
Cn1c2ccccc2n(c(=O)c1=O)Cc3ccon3
|
|
150
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
151
|
c1c[nH]nc1Nc2c(nc(c(n2)Cl)Cl)Cl
|
|
152
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
153
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
154
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
155
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
156
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
157
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
158
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
159
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
160
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
161
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
162
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
163
|
Cc1c2c(n3c(n1)c(cn3)C#N)N(CC2)Cc4ccco4
|
|
164
|
CC1NC(ON1)C2CNCCN2
|
|
165
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
166
|
CC(C)(C)CN1C[C@@H](CC1=O)NC(=O)CCc2cnccn2
|
|
167
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
168
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
169
|
|
|
170
|
CC1CCCC(N1)C2[N-]NNN2
|
|
171
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
172
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
173
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
174
|
c1ccc(cc1)N2CCN(CC2)Cc3nnnn3Cc4ccco4
|
|
175
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
176
|
c1c(=O)nc2n3c1NC(=O)C[C@@]3(CS2)O
|
|
177
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
178
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
179
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
180
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
181
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
182
|
CN(C)c1nc([nH]/c(=NS(=O)(=O)c2ccc(cc2)Cl)/n1)N
|
|
183
|
|
|
184
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
185
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
186
|
c1ccc2c(c1)-c3c(nc4nnnn4n3)C2=O
|
|
187
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
188
|
Cc1ccc(nc1C)c2ccoc2
|
|
189
|
Cc1c(non1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)O[C@@H]3CO
|
|
190
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
191
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
192
|
c1ccc2c(c1)[C@@H]3Cc4cccnc4[C@]2(C3)O
|
|
193
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
194
|
C1[C@@H](N2C=CC=NC2=NC1=O)C(=O)[O-]
|
|
195
|
Cc1c(nccn1)c2ccn[nH]2
|
|
196
|
C1CCC2C(C1)-C3CNCNC3N=C(N2)N4CCCCC4
|
|
197
|
Cc1csc(n1)c2cn(c(=O)[nH]c2=O)C
|
|
198
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
199
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
200
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
201
|
|
|
202
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
203
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
204
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
205
|
Cc1c(cco1)c2nc3ccccc3s2
|
|
206
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
207
|
Cc1cc2nc(cc(=O)n2o1)N(C)Cc3ccsc3
|
|
208
|
c1ccc2c(c1)nc(o2)c3nc4ccccc4s3
|
|
209
|
c1csc2c1C(=O)N[C@@H]3CCCCN3C2
|
|
210
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
211
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
212
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
213
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
214
|
c1cc(oc1)c2ccnc(n2)N
|
|
215
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
216
|
c1ccc2c(c1)nnn2c3ccco3
|
|
217
|
Cc1cc(n(n1)c2nc(cc3n2ncn3)N)C
|
|
218
|
c1cc(cnc1)[C@@]2(CCC=C2)O
|
|
219
|
C1CCC(CC1)[C@@H]2C[C@@H]2NC3=NCCO3
|
|
220
|
c1([n-]nnn1)Nc2[n-]nnn2
|
|
221
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
222
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
223
|
Cc1nc(n(n1)CCNC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
224
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
225
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
226
|
CS(=O)(=O)c1ccc2c(c1CCC(=O)[O-])O2
|
|
227
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
228
|
CN1c2cnc(nc2-c3c(ccs3)S1(=O)=O)N
|
|
229
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
230
|
CC(=O)N[C@@H]1Cc2c1cccc2
|
|
231
|
Cc1cc2n(n1)[C@@H](CC(=N2)O)C(=O)Nc3ccccc3F
|
|
232
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
233
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
234
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
235
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
236
|
CCn1c(cc(n1)NC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
237
|
Cc1cnc(s1)NC(=O)c2c(nsc2NC)C
|
|
238
|
c1cnc(cn1)NC2=NCCN2
|
|
239
|
COc1c2c(ncn1)SCC(=N2)N
|
|
240
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
241
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
242
|
CCSc1ncnc(n1)N
|
|
243
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
244
|
Cc1cc(nc(n1)N)Nn2cnnc2
|
|
245
|
|
|
246
|
C1CCC2C(C1)[C@@](C(=O)N2)(NC3C(NC(C(N3)C#N)C#N)N)O
|
|
247
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
248
|
c1(=O)c(nsnc1Cl)N
|
|
249
|
Cc1cc(n(n1)CNc2nccs2)C
|
|
250
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
251
|
c1ccc2c(c1)Nc3cc(nnc3S2)Cl
|
|
252
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
253
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
254
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
255
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
256
|
CC1(C=C(c2cnccc2O1)N3CCCC3=O)C
|
|
257
|
COCCn1c(=O)ccc(n1)C(=O)n2c3ccccc3c(n2)N
|
|
258
|
|
|
259
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
260
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
261
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
262
|
C[C@@H](Nc1nccs1)n2cncn2
|
|
263
|
c1c(nn2c1OCCC2)CO
|
|
264
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
265
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
266
|
c1ccc2c(c1)c(=O)c(=Nc3ccccn3)c2=O
|
|
267
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
268
|
c1cc(nnc1n2cnnn2)Cl
|
|
269
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
270
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
271
|
Cn1ccnc1COc2ccc(cc2)N
|
|
272
|
CC(=O)n1c(c(nn1)CC#N)c2ccccc2
|
|
273
|
CCOC(=O)Nc1nc2ccn(c2s1)C
|
|
274
|
Cc1c2ccc3c(c2oc(=O)c1Br)[nH]c(=O)o3
|
|
275
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
276
|
COc1c2ccccc2[nH+]c3c1cco3
|
|
277
|
Cc1ccc(nc1)n2cnnn2
|
|
278
|
CS(=O)(=O)N[C@@H]1CCc2c1cccc2
|
|
279
|
c1ccc2c(c1)/C(=N/c3ccccn3)/C(=O)N2
|
|
280
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
281
|
C1CSCC1C2[NH]NC(N2)C3CCSC3
|
|
282
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
283
|
|
|
284
|
CCCc1cc(no1)c2cc(=O)n3c([nH]2)c(c(n3)C)CC
|
|
285
|
CC(C)(C(=O)[O-])n1cncn1
|
|
286
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
287
|
Cc1nc(on1)CNS(=O)(=O)C
|
|
288
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
289
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
290
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
291
|
Cc1c(c(on1)N)[C@@](c2nccn2C)(C(F)(F)F)O
|
|
292
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
293
|
CCOC(=O)N[C@@H]1[C@@H]2CC(=O)[C@H]([C@@H]1OC)O2
|
|
294
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
295
|
C1CNC([NH]1)[C@@H]2CCCCN2C(=O)C3CC3
|
|
296
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
297
|
Cc1c[nH]/c(=NS(=O)(=O)c2ccccc2)/s1
|
|
298
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
299
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
300
|
c1ccc(cc1)Nc2ccccn2
|
|
301
|
c1cc(oc1)C2=CC(=O)Nc3c(non3)N2
|
|
302
|
CNC(=O)Oc1ccccc1
|
|
303
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
304
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
305
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
306
|
Cc1cc2cccc(c2o1)n3cnnn3
|
|
307
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
308
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
309
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
310
|
CCO/C=C/[C@@](CNC(=O)C1CC1)(C(F)(F)F)O
|
|
311
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
312
|
c1c(nnn1CC(=O)[O-])CO
|
|
313
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
314
|
CCOC(=O)Cn1c(noc1=O)Cc2ccccc2
|
|
315
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
316
|
c1cnc(c(n1)C(=O)[C@@H]2CCOC2)Cl
|
|
317
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
318
|
CS(=O)(=O)/N=C(/c1ccc(nc1)C(=O)[O-])[O-]
|
|
319
|
Cc1c(c(on1)C)/C=C/c2c(=O)[nH]c3ccccc3n2
|
|
320
|
Cc1nnc(o1)CSc2ccccn2
|
|
321
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
322
|
C1=C[C@H]2[C@H]3C=C[C@@H]([C@@H]1C(=O)N2)NC3=O
|
|
323
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
324
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
325
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
326
|
Cc1nnc(s1)NC2=NCCO2
|
|
327
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
328
|
c1ccc2c(c1)nc(s2)Nc3c(=O)c(nsn3)Cl
|
|
329
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
330
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
331
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
332
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
333
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
334
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
335
|
CC1=C(Oc2ccccc2O1)c3ccccn3
|
|
336
|
|
|
337
|
c1ccnc(c1)Nc2nsc(=O)n2c3ccccn3
|
|
338
|
c1ccc2c(c1)ncc(n2)c3cnc(nc3c4ccncc4)N
|
|
339
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
340
|
Cc1ccc(cc1)n2c(nnn2)c3nc4ccccc4s3
|
|
341
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
342
|
Cc1c(c(n(n1)Cc2[n-]nnn2)C)Br
|
|
343
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
344
|
Cc1ncc2c(n1)NC(=O)NC2
|
|
345
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
346
|
Cn1ccc(n1)C(=O)n2cccn2
|
|
347
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
348
|
CCOc1ccccc1N[C@@]2(CSc3n2c(=O)cc(n3)C)O
|
|
349
|
CC1C2C(C(CN1)CO)C=C3CCCC=C3O2
|
|
350
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
351
|
CC(C)c1nc([nH]n1)CC#N
|
|
352
|
Cn1c(nc(n1)Br)n2ccnc2
|
|
353
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
354
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
355
|
Cn1cnc2c1ccnc2C(=O)NCC(=O)[O-]
|
|
356
|
c1ccc(cc1)n2cccc2c3nc(nc(n3)Cl)Cl
|
|
357
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
358
|
C1CNNCC1CCC(=O)[O-]
|
|
359
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
360
|
C1CCC(CC1)NN2CNC3C2C4CCCCC4CC3
|
|
361
|
Cc1nc(on1)[C@@H](C)Nc2nccc(n2)OC
|
|
362
|
c1nc2n(n1)C(=O)[C@@H](S2)CCO
|
|
363
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
364
|
CS(=O)(=O)NC1=NCN(CN1)C2CC2
|
|
365
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
366
|
CC(C)C(=O)Nc1nc[nH]n1
|
|
367
|
Cc1c(nnn1c2cc(cnc2C#N)C(F)(F)F)C(=O)C
|
|
368
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
369
|
|
|
370
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
371
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
372
|
C1CCC2C(C1)C(=O)N3C(S2)NC(N3)N
|
|
373
|
CC=C(C(=O)N/C1=C/c2ccccn2)C
|
|
374
|
Cc1c(oc(n1)S[C@@H](C)c2cccnc2)C
|
|
375
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
376
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
377
|
Cc1c(oc(n1)NS(=O)(=O)c2ccc(cc2)N)C
|
|
378
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
379
|
Cc1nnc(o1)CSc2nccn2C
|
|
380
|
Cn1c(ccn1)c2nnc(o2)N
|
|
381
|
CNC(=O)c1c2c(c(=O)oc1N)nns2
|
|
382
|
c1ccc2c(c1)c(ns2)NCc3cccs3
|
|
383
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
384
|
Cc1c(cnn1c2ccccc2)c3ccnn3C(=O)c4ccco4
|
|
385
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
386
|
CSc1c-2c(cs1)CCc3c2n[nH]c3
|
|
387
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
388
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
389
|
c1ccc2c(c1)nc3c(n2)Sc4nncn4N3
|
|
390
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
391
|
CC(C)c1cc(=O)[nH]c(n1)[C@@H]2CCCN2C(=O)CCOC
|
|
392
|
CC(=O)Nc1c(cn[nH]1)C#N
|
|
393
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
394
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
395
|
Cc1c(non1)c2c3c(non3)n(n2)C(=O)C
|
|
396
|
c1cc2c(nc1)n(c(=O)o2)CCN3CCOCC3
|
|
397
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
398
|
C1CCC(CC1)CNC(=O)/N=C/2N-3C(NS2)CC4C3CCCC4
|
|
399
|
COC(=O)Nc1cn2ccccc2n1
|
|
400
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
401
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
402
|
CC1=C([C@@H](n2c(ncn2)N1)c3ccoc3)C(=O)N
|
|
403
|
|
|
404
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
405
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
406
|
C1CCC2C(C1)CC3C(N2)-C4C(C5COCC5C(=O)N4C3)O
|
|
407
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
408
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
409
|
CC(C)c1nc(=O)cc(o1)C(F)(F)F
|
|
410
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
411
|
CC(=O)Nn1c2ccccc2nn1
|
|
412
|
CCn1c2c(c(=O)n3c1c(cn3)C(=O)[O-])CN(CC2)C
|
|
413
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
414
|
c1csc2c1c(ncn2)n3ccnc3
|
|
415
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
416
|
COc1cc(nc(n1)Oc2ccccc2c3ccno3)OC
|
|
417
|
Cc1cc(nc2c1c(c(o2)C(=O)C)N)C
|
|
418
|
c1cnc2c(n1)c(cs2)N
|
|
419
|
CCN1[C@@H]2[C@@H](NS(=O)(=O)N2)N(C1=O)CC
|
|
420
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
421
|
c1ccc2c(c1)nn(n2)S(=O)(=O)N
|
|
422
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
423
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
424
|
CC1=NC2=NC(=NC(=O)C2=C1Sc3ccccn3)[NH-]
|
|
425
|
c1ccc2c(c1)C(=NS2(=O)=O)Nc3ccccn3
|
|
426
|
c1ccc(c(c1)C(=O)[O-])Sc2c(nccn2)Cl
|
|
427
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
428
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
429
|
CC1(c2cccnc2NC1=O)C
|
|
430
|
COC1NC-2NCCC2C3N1CCO3
|
|
431
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
432
|
CCOC(=O)N1c2ccccc2O[C@@H]1C#N
|
|
433
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
434
|
|
|
435
|
Cc1n[nH]/c(=NC(=O)CCC(=O)NC2CCCCC2)/s1
|
|
436
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
437
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
438
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
439
|
c1ccc(cc1)Oc2nc3ccccn3c(=O)n2
|
|
440
|
c1cc(oc1)Cn2c(ccn2)N
|
|
441
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
442
|
c1ccc(cc1)COc2c(nccn2)N
|
|
443
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
444
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
445
|
C=CCSc1nc2c(c(n1)c3cccs3)CCCC2
|
|
446
|
c1cnc2c(n1)C(=O)NCN2
|
|
447
|
CNc1nnc(s1)c2cnccn2
|
|
448
|
Cc1c(cco1)c2nnc(n2C)SC
|
|
449
|
CC1([C@H]([C@@H](c2c(cccn2)O1)N3CCCC3=O)O)C
|
|
450
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
451
|
c1nc2c(c(n1)N)N=C[C@H]2[C@@H]3[C@@H]([C@H]([C@@H](O3)CO)O)O
|
|
452
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
453
|
COC(=O)c1cc2c(n1C(=O)OC)snn2
|
|
454
|
Cc1c(non1)NS(=O)(=O)c2ccccc2
|
|
455
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
456
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
457
|
CSc1/c(=CN)/n2cnnc2n1
|
|
458
|
c1cc(sc1)S(=O)(=O)n2cccn2
|
|
459
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
460
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
461
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
462
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
463
|
|
|
464
|
CC1=C([C@@H](C(=C(O1)N)C(=O)OC)c2ccc[nH]2)C(=O)N
|
|
465
|
c1ccnc(c1)SCCn2cccn2
|
|
466
|
Cn1c(ccn1)c2c(snn2)C(=O)[O-]
|
|
467
|
c1c([nH]nn1)SCC(=O)N
|
|
468
|
Cc1csc(n1)c2nnc(o2)N
|
|
469
|
Cc1csc(n1)C[C@@](c2nccn2C)(C(F)(F)F)O
|
|
470
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
471
|
C12C(NC(S1)C(=O)[O-])SC(N2)C(=O)[O-]
|
|
472
|
CSc1c(cccn1)C#N
|
|
473
|
Cc1c(c2nnnn2c(n1)c3ccccn3)Cl
|
|
474
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
475
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
476
|
COc1ccc2c(n1)cc([nH]2)C=C
|
|
477
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
478
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
479
|
c1ccnc(c1)CS(=O)(=O)[O-]
|
|
480
|
c1csc(n1)n2cnnn2
|
|
481
|
c1c2c([nH]c1C(=O)[O-])nco2
|
|
482
|
CN1CCn2ccc3c2c1nc(=O)[nH]3
|
|
483
|
c1c(=O)nc2n3c1NC(=O)Cc3cs2
|
|
484
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
485
|
CC1CNC(S1)/N=C/2N(CC(S2)C)C3NCC(S3)C
|
|
486
|
CN1CCOc2c1cnn(c2=O)CCO
|
|
487
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
488
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
489
|
c1ccc(cc1)NC(=O)Nc2ccno2
|
|
490
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
491
|
C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O)NC(=O)C)O
|
|
492
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
493
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
494
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
495
|
|
|
496
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
497
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
498
|
c1cn[nH]c1NC(=O)CC#N
|
|
499
|
C=CCNc1nc(ns1)N
|
|
500
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
501
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
502
|
c1ccnc(c1)Nc2cccs2
|
|
503
|
c1ccc2c(c1)/C(=N/c3[nH]c4ccccc4n3)/NC2=O
|
|
504
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
505
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
506
|
CSc1nc(n(n1)c2nncn2N)N
|
|
507
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
508
|
Cc1c(c(n(n1)C)Sc2ccccn2)N
|
|
509
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
510
|
Cc1ccc2c(c1)-c3c(nn4c(n3)nnn4)C(O2)(C)C
|
|
511
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
512
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
513
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
514
|
c1cc2c(ccc3c2nno3)c(c1)S(=O)(=O)[O-]
|
|
515
|
C(CS(=O)(=O)N)NC(=O)N
|
|
516
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
517
|
Cc1nc(c(s1)c2nc[nH]n2)C(F)(F)F
|
|
518
|
COC(=O)CCCC1CCC(=O)N2C1NCCC2
|
|
519
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
520
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
521
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
522
|
Cc1cc(ncc1[C@@H](CC(=O)N)n2cccc2)C
|
|
523
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
524
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
525
|
CC(C)(C)c1cc2n(n1)C3=NCCN3C=N2
|
|
526
|
c1nc(nn1CC(=O)N)C#N
|
|
527
|
c1cc(oc1)C(=O)/C=C/2C(=O)NCCN2
|
|
528
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
529
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
530
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
531
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
532
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
533
|
CC(=O)c1csc(n1)c2ccno2
|
|
534
|
c1ccc2c(c1)-n3cnnc3CCS2
|
|
535
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
536
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
537
|
c1cnn(c1)CN2CCCC2
|
|
538
|
c1c[nH]nc1C2CCCCC2
|
|
539
|
Cc1ccc-2nc(nc2c3c1[nH]c(=O)[nH]3)N(C)C
|
|
540
|
c1cc(ccc1Oc2nc(ns2)Cl)F
|
|
541
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
542
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
543
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
544
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
545
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
546
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
547
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
548
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
549
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
550
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
551
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
552
|
c1cc(cnc1)Cc2c3[nH]c4c(c(=O)n3[nH]c2=O)CCC4
|
|
553
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
554
|
c1ccc2c(c1)nnn2S(=O)(=O)c3ccco3
|
|
555
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
556
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
557
|
CC[C@H]1[C@H](C(=O)N1)NC(=O)OC
|
|
558
|
Cc1cc(no1)c2nnnn2c3ccc(cc3)F
|
|
559
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
560
|
CSc1c(c(sn1)SC)NC(=O)N2CCCC2
|
|
561
|
CCN(CC)C1C(NNC2N1NC3C2CCCN3)C
|
|
562
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
563
|
CC1=C[C@@H](n2c(ncn2)N1)c3ccccc3F
|
|
564
|
Cc1cnc(o1)Cn2cccn2
|
|
565
|
C1C[C@@H](OC1)C(=O)NC2CC2
|
|
566
|
C1C[C@@H](OC1)c2nnc(o2)N
|
|
567
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
568
|
C1CCC2C(C1)C(=O)N3CCCC3[C@@H](N2)O
|
|
569
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
570
|
Cc1ccc(cc1)c2c(sc(n2)C)Cc3nnc(o3)N
|
|
571
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
572
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
573
|
c1ccc2c(c1)C[NH2+]C2=C(C#N)C#N
|
|
574
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
575
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
576
|
CC(C)NC(=O)N[C@H]1COCCO1
|
|
577
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
578
|
c1cc(oc1)CSc2nccs2
|
|
579
|
CC1NC(C(NN1)C(=O)N)[O-]
|
|
580
|
C1Cc2c3c(nnc4c3c(nn2)CCC4)C1
|
|
581
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
582
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
583
|
Cc1c(cco1)c2nnc(o2)N
|
|
584
|
c1cnn(c1)c2cncc(n2)Cl
|
|
585
|
Cc1c2c(n3c(n1)nnn3)CCC2
|
|
586
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
587
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
588
|
CCn1c(c(c(nc1=O)O)NC)NC(=O)c2c(ncs2)C
|
|
589
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
590
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
591
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
592
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
593
|
c1cc(cnc1)C(=O)c2c3c(ccs3)nc(n2)C(F)(F)F
|
|
594
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
595
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
596
|
COc1c2cc[nH]c2[nH]c(=O)n1
|
|
597
|
Cc1nc(no1)CSc2nncs2
|
|
598
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
599
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
600
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
601
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
602
|
CN(C)C1=NS(=O)(=O)N=C(O1)N(C)c2ccccc2
|
|
603
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
604
|
|
|
605
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
606
|
Cc1nn(c(=O)c2n1ccn2)CC(=O)OC
|
|
607
|
CC1=N[C@@](C(=O)O1)(C)NC(=O)C
|
|
608
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
609
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
610
|
C1C(=O)N[C@@H]2C=CC=CN2C1=O
|
|
611
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
612
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
613
|
c1ccc(cc1)CNc2ncco2
|
|
614
|
CC1=C([C@@H](N2C(=N1)NC=N2)c3ccccn3)C(=O)N
|
|
615
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
616
|
c12c(c(n[nH]c1=O)[O-])non2
|
|
617
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
618
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
619
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
620
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
621
|
c1ccc2c(c1)nnn2C3=[NH+]CCN3
|
|
622
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
623
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
624
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
625
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
626
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
627
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
628
|
CCnccn2c(/c1=Nc3ccccc3)nnn2
|
|
629
|
C[C@@H]1C2=C(COC2=O)NC(=O)N1
|
|
630
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
631
|
c1cnc(c(n1)C#N)n2ccnc2
|
|
632
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
633
|
CC(=O)OC1=CC=CNC1=C(C#N)C#N
|
|
634
|
CC1=C[C@@H](CC(=O)N1)c2ccco2
|
|
635
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
636
|
c1nnn(n1)C[C@@H]2CCOCO2
|
|
637
|
Cc1ccc(cc1)N(CC2=NCNC2)c3cccc(c3)O
|
|
638
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
639
|
COC1CCCC2C1OC(=C(C2)C(=O)N)NC3CCCCC3
|
|
640
|
Cc1cc-2n(n1)[C@@H](Nc3c2cccc3)c4cccnc4
|
|
641
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
642
|
CCOc1nc(nc(n1)N)C
|
|
643
|
CC1NC(NO1)C2CN3C(C2C(C)C)C(=O)NC[NH]3
|
|
644
|
Cc1c-2c(n(n1)c3ccccn3)CCc4c2onc4
|
|
645
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
646
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
647
|
C1Cc2c(n[nH]c2C(=O)[O-])C1
|
|
648
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
649
|
c1ccnc(c1)[C@@H]2Nc3c(c4c(s3)CCCC4)C(=O)N2
|
|
650
|
CNC(=O)c1c2c(ccs2)nc(n1)NCc3cccnc3
|
|
651
|
C/C(=C/1CCOC1=O)/NC(=O)C
|
|
652
|
Cc1nc(c(o1)C(F)(F)F)c2nc(on2)c3ccccc3
|
|
653
|
CCCNC(=O)Cc1nc[nH]n1
|
|
654
|
Cc1c(c(sn1)C)Nc2c(c(ncn2)SC)C#N
|
|
655
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
656
|
CCOC(=O)c1c(c([nH]c1Br)C(=O)OCC)C
|
|
657
|
CCCCn1c(c(c2c1ncn(c2=[NH2+])c3nccs3)C)C
|
|
658
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
659
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
660
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
661
|
Cc1cc(n(n1)c2nc(c(nn2)C)[O-])C
|
|
662
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
663
|
CN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)NC1=O)O
|
|
664
|
Cc1c(sc2c1c(=O)sc(n2)N)C
|
|
665
|
Cc1nc-2n(n1)C=COc3c2cccc3
|
|
666
|
CS(=O)(=O)Oc1ccccn1
|
|
667
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
668
|
C[C@@H]1CCCC[C@@H]1NC(=O)COc2cnc(nc2)c3ccccc3
|
|
669
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
670
|
Cc1c(c(no1)c2ccccc2)c3ccn[nH]3
|
|
671
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
672
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
673
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
674
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
675
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
676
|
CC(=O)NC1NCNC(N1)N
|
|
677
|
c1cc(cnc1)c2cccs2
|
|
678
|
Cc1cc(nc(n1)Nc2c(nn[nH]2)C(=O)C)C
|
|
679
|
Cc1nc(no1)c2ncon2
|
|
680
|
c1cc(ncc1C#N)NCc2nccs2
|
|
681
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
682
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
683
|
Cc1nccn1C(=O)c2cccs2
|
|
684
|
CC1CC2CC(OC2C3C1C(NNC3CL)CL)C
|
|
685
|
Cn1cccc1CNc2[n-]nnn2
|
|
686
|
C1CC1C(=CC(=O)[O-])C2CC2
|
|
687
|
C[C@@H]1NC(=C2C(=N1)NC[NH]2)C(=O)N
|
|
688
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
689
|
c1ccc(cc1)Nc2nccs2
|
|
690
|
CCc1c(c(on1)C)c2nn3c(nnc3s2)C
|
|
691
|
Cn1c(ccn1)c2nnc(n2C)SC
|
|
692
|
c1ccc(cc1)c2c3c(oc(=O)c2C(=O)[O-])C[C@@H](C=C3)O
|
|
693
|
c1cnc(c2c1n3c(ccn3)nn2)[O-]
|
|
694
|
c1cnn2c1ncc3c2C(=O)OCC3
|
|
695
|
Cc1c(non1)OCCOc2c(non2)C
|
|
696
|
CC(=O)N[C@@H]1CCC=C1C2=CCC[C@H]2NC(=O)C
|
|
697
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
698
|
Cc1cc(=O)n2c(n1)nc(c(n2)C)[O-]
|
|
699
|
|
|
700
|
C=CCOc1cccnc1N
|
|
701
|
CC(=O)Nn1cnc2c1cccc2
|
|
702
|
C1CCC(C1)c2nnc(o2)N
|
|
703
|
CNC(=O)OCC#CCOC(=O)NC
|
|
704
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
705
|
Cc1ccc(cc1)n2c3c[nH]c(=O)nc3cn2
|
|
706
|
c1ccc(c(c1)C(=O)[C@@H]2C(=NN=N2)C(F)(F)F)O
|
|
707
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
708
|
Cc1c(non1)c2ccn[nH]2
|
|
709
|
c1cc(cc(c1)OCc2cscn2)N
|
|
710
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
711
|
c1nc2c(s1)c(=O)[nH][nH]c2=O
|
|
712
|
CC1CC(N2C1[C@@H](CC2)O)C3(C(=O)C4CCCCC4C3=O)O
|
|
713
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
714
|
C1=N[C@@H]2[C@@H](N1)NC(=NC2=O)[NH-]
|
|
715
|
Cc1cnnn1c2c(nn(c2C)C)C
|
|
716
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
717
|
Cc1cc(nc(n1)Nc2cc(on2)C)C#N
|
|
718
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
719
|
c1cc(oc(=O)c1)c2cccnc2
|
|
720
|
CNc1c2c(nc(n1)N)non2
|
|
721
|
|
|
722
|
Cc1cc(n(n1)c2ncccn2)C
|
|
723
|
c1ccc2c(c1)C(=O)NCCO2
|
|
724
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
725
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
726
|
c1ccc(cc1)c2cncnc2
|
|
727
|
C1CCC2C(C1)-C3CCCNC3S2(=O)=O
|
|
728
|
c1cnc2c(n1)c(nnc2[O-])[O-]
|
|
729
|
CC(=O)NC[C@@H](c1ccco1)S(=O)(=O)c2ccccc2
|
|
730
|
c1ccc(cc1)C(=O)NCn2cncn2
|
|
731
|
C[C@@H]1Nc2ccccc2-c3c(nc(nn3)SC)O1
|
|
732
|
C[C@@H](c1ccccc1)N(C)Cc2nccn2C
|
|
733
|
CC1=CC(=O)Nc2ccccc2N1
|
|
734
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
735
|
Cc1[nH]n(c2c(c(=O)c2=O)n(n1)C)C
|
|
736
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
737
|
Cc1cc(nc(n1)N2CC(=NC(=C2)C)OC)OC
|
|
738
|
Cc1nc(cs1)Cn2c(=O)oc(n2)c3ccc(cc3)F
|
|
739
|
C1CCC2C(C1)NS(=O)(=O)CCO2
|
|
740
|
C[C@@H]1[C@@H](NC2C(CNCN2)N1)C
|
|
741
|
CC(C)(C)OC(=O)NCC#C
|
|
742
|
c1ccc(c(c1)C(F)(F)F)N2Cc3cnc4ncnn4c3C=C2
|
|
743
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
744
|
Cn1cc(cn1)c2ccncn2
|
|
745
|
CCC(=O)Nc1ncccn1
|
|
746
|
C1NC2N(N1)[C@@H]3C[C@](N2)([C@H]4OC[C@@H]3O4)O
|
|
747
|
Cc1nc2nncn2c(n1)[O-]
|
|
748
|
c1ccc2c(c1)nc3n2-c4ccc(cc4CS3)N
|
|
749
|
Cc1cc(c(c(c1)O)c2c(c[nH]n2)c3nc(cs3)C)O
|
|
750
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
751
|
Cc1ccccc1CN(C)Cn2cnnc2C#N
|
|
752
|
Cc1cc(no1)c2nnc(o2)N
|
|
753
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
754
|
|
|
755
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
756
|
C[C@@H]1C=CN(c2n1ncc2C(=O)[O-])C
|
|
757
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
758
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
759
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
760
|
Cc1cc2c(cn1)C(=O)OCC2
|
|
761
|
Cc1cc(no1)CS(=O)(=O)NC
|
|
762
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
763
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
764
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
765
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
766
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
767
|
C=CCOC1CCNC(N1)N
|
|
768
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
769
|
CSc1c(c(c(s1)c2cc[nH]n2)c3ccco3)C#N
|
|
770
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
771
|
CC(=O)c1ccc(c(c1)F)Sc2nncs2
|
|
772
|
Cc1c(nccn1)c2ccnn2S(=O)(=O)c3ccccc3
|
|
773
|
c1ccc2c(c1)c(=O)[nH]c3n2nnc3
|
|
774
|
C[C@@H](Cc1ccco1)NS(=O)(=O)C
|
|
775
|
Cc1cc(c(s1)C)c2c(oc(=O)o2)c3cc(sc3C)C
|
|
776
|
Cn1c(ncn1)c2csc(n2)c3ccncc3
|
|
777
|
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
|
|
778
|
CC1NC(ON1)C2CCC3C(C2)SCN3
|
|
779
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
780
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
781
|
Cc1cc(n(n1)c2ccccn2)Nc3c(=O)[nH]c4ccccc4n3
|
|
782
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
783
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
784
|
|
|
785
|
Cc1c2c(nnn2[O-])n(n1)C
|
|
786
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
787
|
c1cc2c(nc1)onc2Cl
|
|
788
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
789
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
790
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
791
|
CCSc1ccc(nn1)N
|
|
792
|
Cc1cc(on1)c2c(n(c(=O)n(c2=O)C)C)O
|
|
793
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
794
|
CC(=O)C1C2C(NC(N1)C(=O)C)N(CN2)C(=O)C
|
|
795
|
CCSc1nncn1Cc2ccco2
|
|
796
|
C(CS(=O)(=O)c1c(c(nc(c1Cl)F)F)F)O
|
|
797
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
798
|
c1cc2c(nc1)C(=O)c3ccc(cc3CC2)Cl
|
|
799
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
800
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
801
|
CS(=O)(=O)c1c(c(on1)c2cccs2)C#N
|
|
802
|
c1cc2c(c3c1[nH]cn3)c(c(cn2)c4[n-]nnn4)O
|
|
803
|
C1CCC(CC1)C2C(C3CNCCC3O2)C#N
|
|
804
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
805
|
C1(=NS(=O)(=O)N=C1C(=O)[O-])C(=O)[O-]
|
|
806
|
Cc1nc(no1)Cn2cccc(c2=O)C(F)(F)F
|
|
807
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
808
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
809
|
C1CCN(C1)c2c(=O)c(nsn2)Cl
|
|
810
|
Cc1cnc(nc1c2ncnn2C)N
|
|
811
|
COC(=O)CC1(C(=O)NC(=O)N=C1[O-])CC(=O)OC
|
|
812
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
813
|
CN(C)C(=O)Nc1n[n-]nn1
|
|
814
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
815
|
C=CCNC1CCNC(N1)N
|
|
816
|
c1cc2c3c(c1)NC(=O)C4=C(N3CCC2)CCC4
|
|
817
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
818
|
C[C@@H]1Cn2c(cc3c2c(ccc3)O1)C(=O)[O-]
|
|
819
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
820
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
821
|
Cc1c(c(on1)C)n2c(=O)n(c(=O)s2)CC3CC3
|
|
822
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
823
|
CC(=O)NCCn1cccc1
|
|
824
|
Cc1nnc(s1)Sc2c(n(c(=O)[nH]c2=O)C)N
|
|
825
|
c1c[nH]c2c1cc3c(c2)OCO3
|
|
826
|
COC(=O)c1c2n(cn1)C[C@@H](OC2=O)COc3ccccc3
|
|
827
|
Cc1ccc(cc1C)c2c(cccn2)OC3(CCCC3)C(=O)[O-]
|
|
828
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
829
|
Cc1cc2nc(nc(n2n1)N)N
|
|
830
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
831
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
832
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
833
|
C1COC(N1)NC2CCCCC2
|
|
834
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
835
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
836
|
Cc1c(nc(c(n1)C(=O)NC)NC)CCC(=O)[O-]
|
|
837
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
838
|
c1ccc2c(c1)cccc2C[C@@H]3NCC=N3
|
|
839
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
840
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
841
|
CC(C)n1/c(=N/c2ccccc2)/c3ccccc3nn1
|
|
842
|
CC(C)(C)N(c1ccoc1)C(=O)[O-]
|
|
843
|
c1ccc(c(c1)C(=O)C2=C[C@H](C(=O)N=C2)C#N)O
|
|
844
|
Cn1cc(nc1)S(=O)(=O)Oc2ccsc2C(=O)OC
|
|
845
|
|
|
846
|
c1ccc(cc1)Nn2cncn2
|
|
847
|
CC(=O)NCc1ccccn1
|
|
848
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
849
|
c1cc2c(=O)[nH]c3c(n2c1)ccs3
|
|
850
|
c1cnc(cn1)c2nnc(o2)N
|
|
851
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
852
|
C1[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](N2S(=O)(=O)N1)O)O)O)O
|
|
853
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
854
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
855
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
856
|
CCNC(=O)Cn1ccnc1
|
|
857
|
c1ccc2c(c1)-c3ccccc3S(=O)(=O)N2
|
|
858
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
859
|
CCOc1c(c(=O)c(c(o1)OCC)C)C
|
|
860
|
C[C@@H]1CC=CCN(C1)S(=O)(=O)c2ccccn2
|
|
861
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
862
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
863
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
864
|
Cc1c(c(no1)C(=O)OC)c2cc[nH]n2
|
|
865
|
Cc1nccn1c2c(cnc(n2)N3CCOCC3)F
|
|
866
|
Cc1c2c(c3ccccc3[nH]2)c4c([o+]1)CCCC4=O
|
|
867
|
C1C#C/C=CC#CC[C@@H]([C@@H]1CO)CO
|
|
868
|
c1ccc2c(c1)Oc3c(c(nc(c3F)F)F)O2
|
|
869
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
870
|
c1ccc2c(c1)-c3cccnc3C2=O
|
|
871
|
CC1=NCCNc2c1c(=O)n(c3c2cccc3)C
|
|
872
|
c1csc2n1c(=O)[nH]c(=O)n2
|
|
873
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
874
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
875
|
COC(=O)/C=c/c(=O)n2c(s1)ncn2
|
|
876
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
877
|
C1CC(OC1)C2C3C(CNNC3OC2C4CCCO4)N
|
|
878
|
|
|
879
|
COC1=NS(=O)(=O)C=C(O1)C2CCCCC2
|
|
880
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
881
|
c1ccc(cc1)NCC(=O)[O-]
|
|
882
|
CNC(=O)N/C=C/c1ccco1
|
|
883
|
CC(=O)N[C@@H](CS/N=N/c1ccccc1)C(=O)[O-]
|
|
884
|
c1cc2c(c3c1noc3)nco2
|
|
885
|
CN1c2ccc(cc2-c3n[nH]c(=O)c(=O)n3CC1=O)Cl
|
|
886
|
c1cc(oc1)c2c(sc3c2c(c(s3)C#N)N)C#N
|
|
887
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
888
|
CCOC=C(c1nnco1)c2nnco2
|
|
889
|
c1cc2c(nc1C#N)CCCN2
|
|
890
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
891
|
Cc1nc(on1)CNC(=O)C
|
|
892
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
893
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
894
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
895
|
C(C(=O)[O-])n1c(nnc1Cl)Cl
|
|
896
|
c1cc(sc1)c2cc(c(nn2)O)NC(=O)C3CCC3
|
|
897
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
898
|
c1cnccc1c2n[nH]c(=O)s2
|
|
899
|
c1ccc(cc1)n2c(noc2=O)c3cccnc3
|
|
900
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
901
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
902
|
c1cc(c(nc1)c2ccco2)N
|
|
903
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
904
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
905
|
c1ccc2c(c1)nn(n2)[C@@H](c3ccco3)C(=O)c4cccs4
|
|
906
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
907
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
908
|
C1CC[C@@H]2[C@@H](C1)NC(=O)C(=N2)CCC(=O)[O-]
|
|
909
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
910
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
911
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
912
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
913
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
914
|
Cc1cc(nc2c1c(nn2C)n3c(c(nn3)C#N)N)C
|
|
915
|
Cc1c(=O)n2c(nn1)n(cn2)Cc3ccccc3
|
|
916
|
Cc1nc2c(n1C)CCN(C2)C[C@@H](c3ccc(cc3)OC)O
|
|
917
|
c1cc(oc1)c2ccnc3n2ncc3
|
|
918
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
919
|
Cc1csc(n1)c2c(non2)N
|
|
920
|
c1ccc2c(c1)[nH]c(n2)c3ccco3
|
|
921
|
CN1CCC(=CC1)C2=NC=CC2
|
|
922
|
c1cc(oc1)c2c(sc(c2c3ccco3)C(=O)N)C#N
|
|
923
|
Cc1cs/c(=N/c2c(nc[nH]2)C(=O)N)/n1c3ccccc3
|
|
924
|
Cc1c(c(c2ncnn2n1)[O-])Cl
|
|
925
|
Cc1c(noc1N2CCOC2=O)C
|
|
926
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
927
|
C1=N[C@@H]2C(=N1)N=C(N=C2Cl)N
|
|
928
|
c1cc(sc1)c2cc(nc3c2c(c(o3)C(=O)[O-])N)C(F)(F)F
|
|
929
|
c1ccc2c(c1)[C@@H]3C4=C(CCCC4)C(=C3NC2=O)C(=O)N
|
|
930
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
931
|
Cc1c2c(cc(c(=O)o2)NC(=O)C)c(cn1)CO
|
|
932
|
Cc1c(nc(c(c1C#N)C#N)OC)/C=C/c2ccco2
|
|
933
|
CCOc1c(nc(o1)C#N)C
|
|
934
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
935
|
Cc1cc(nn2c1nnc2)n3ccnc3
|
|
936
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
937
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
938
|
CCN(CC)C1=Nc2ccccc2-n3ccnc3C1
|
|
939
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
940
|
Cc1c(c(on1)C)c2nc(no2)CN3CCOCC3
|
|
941
|
COc1c2ccoc2c(c(c1c3cc(n[nH]3)C(F)(F)F)O)OC
|
|
942
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
943
|
CCCc1c(snn1)CC
|
|
944
|
Cn1c(=O)n2n(c1=O)[C@H]3C[C@@H]2C=C3
|
|
945
|
Cc1nnc(s1)N[C@@]2([C@@H](C(=NC2=O)C)C#N)C(F)(F)F
|
|
946
|
Cc1c(cccn1)C2=NCCC2
|
|
947
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
948
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
949
|
c1ccc2c(c1)nc3c(n2)C4=CC=CC5=CC=C[C@@H]3[C@@H]54
|
|
950
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
951
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
952
|
CC(C)n1c2c(nn1)CCCC2
|
|
953
|
c1cc(ncc1C#N)Sc2nccs2
|
|
954
|
c1ccc(cc1)c2nccn2c3ccnc(n3)Nc4ccccn4
|
|
955
|
Cc1ccc(n1c2cnccn2)C
|
|
956
|
CC(C)NC(=O)CSc1nnns1
|
|
957
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
958
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
959
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
960
|
c1cnn(c1)c2nncn2N
|
|
961
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
962
|
Cc1nccn1C(=O)[C@@H]2[C@@H]3C[C@H]([C@@H]2C(=O)[O-])C=C3
|
|
963
|
c1cc2c(csc2nc1)N3CCCC3
|
|
964
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
965
|
|
|
966
|
C(#N)c1c(c([nH]c1N)Br)C#N
|
|
967
|
Cc1c(cc(o1)C(=O)[O-])Sc2ccccc2C(=O)[O-]
|
|
968
|
C[C@@H]1C[C@@H](n2c(ncn2)N1)c3ccccc3
|
|
969
|
COc1nc2c(cc[nH]2)c(n1)Cl
|
|
970
|
Cc1c(snn1)c2cc(nc(n2)SC)[O-]
|
|
971
|
c1cc(ccc1C(=O)[O-])Oc2c(nccn2)N3CCCC3
|
|
972
|
c1c(c(c(=O)n(n1)Cc2c(snn2)Cl)Cl)Cl
|
|
973
|
CC1CCC2C3C1C(=O)[C@@H](C3=CCN2C(=O)C)C(=O)N
|
|
974
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
975
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
976
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
977
|
|
|
978
|
CCOC1C-2C(NC(N1)N)CCC3C2CCCC3
|
|
979
|
c1cn2c(c1CO)[C@@H](CC2)O
|
|
980
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
981
|
C1CCC(CC1)C2CCNN2S(=O)(=O)C3=CC=CCC=C3
|
|
982
|
c1nc2n(n1)C(=O)CC(=N2)[O-]
|
|
983
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
984
|
CCOC(=O)C1CN(C2C1C(=O)[C@@H](CC(=O)N2)C(=O)OCC)C
|
|
985
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
986
|
c1ccc(cc1)C(=O)c2ccco2
|
|
987
|
C[C@@]1(c2cccn2-c3ccccc3CO1)C(=O)[O-]
|
|
988
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
989
|
CCCOn1c(nnn1)c2ccccc2
|
|
990
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
991
|
c1nc2n(n1)C[C@@H](CS2)O
|
|
992
|
Cc1c(c(n(n1)C)n2cncn2)N
|
|
993
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
994
|
c1cc(nnc1n2ccnc2)[O-]
|
|
995
|
c1cc(cnc1)Br
|
|
996
|
c1csc(n1)/N=C(/CN2CCOCC2)[O-]
|
|
997
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
998
|
c1cc(cc(c1)S(=O)(=O)/N=c/2[nH]c(c3c(n2)nc[nH]3)[O-])C#N
|
|
999
|
|
|
1000
|
Cc1cc(n(n1)S(=O)(=O)C)C
|
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