(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
2
|
CCOC(=O)/C=C/1C2NNNN2-C3CCCCC3N1
|
|
3
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
4
|
|
|
5
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
6
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
7
|
c1ccc2c(c1)c(=O)n(nn2)Cn3cnc(n3)C#N
|
|
8
|
CC1C2C(NNC1NC(=O)C)C[C@@H](C2)C(=C)C
|
|
9
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
10
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
11
|
CC1CC2CC3CCCNN3C2NN1
|
|
12
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
13
|
c1ccc(cc1)c2c3c([nH]n2)OC(=O)C[C@@H]3c4ccccc4
|
|
14
|
Cc1c(cnc(c1C#N)N)Cc2cc(ccc2OC)OC
|
|
15
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
16
|
Cc1c(c2c(s1)c(=O)[nH]nn2)C(=O)[O-]
|
|
17
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
18
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
19
|
c1cnc(nc1)Sc2cnnc(c2Cl)[O-]
|
|
20
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
21
|
c1ccc(cc1)c2c3c(n[nH]c3nnc2c4ccccc4)N
|
|
22
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
23
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
24
|
Cc1c(sc2c1/c(=[NH+]/Cc3cn4ccccc4n3)/nc[nH]2)C
|
|
25
|
c1ccc2c(c1)N3CCCN2c4c3cc(nn4)Cl
|
|
26
|
C[C@@]12CCC(=O)N1CCN2C(=O)c3ccc(o3)COC
|
|
27
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
28
|
CCCCCCC1CN[NH]N1
|
|
29
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
30
|
c1cc2c3ccnn3nnc2cc1Cl
|
|
31
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
32
|
c1ccc2c(c1)nc3n2C4(CCCC4)NC(=[NH+]3)N
|
|
33
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
34
|
CCc1cc(c(cc1OC)O)c2c(cn[nH]2)c3nc(cs3)C
|
|
35
|
c1cnc(c2c1n3c(ccn3)nn2)[O-]
|
|
36
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
37
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
38
|
Cc1cc(nc2c1c3c(s2)c(n[nH]3)c4ccccc4)C
|
|
39
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
40
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
41
|
CC(C)C1C(C2CC3C(CC2NN1)C4CCCCC4O3)N
|
|
42
|
c1ccc(cc1)n2c(c(c(nc2=O)Cn3cncn3)C#N)N
|
|
43
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
44
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
45
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
46
|
c1cc(nnc1n2cnnn2)Cl
|
|
47
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
48
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
49
|
Cc1ccc(n1c2[n-]c(nn2)SCCCC(=O)[O-])C
|
|
50
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
51
|
CC1CCC(CC1)S(=O)(=O)C2CN[NH]N2
|
|
52
|
Cc1c2cc3c(nc2on1)C(=O)OCC3
|
|
53
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
54
|
Cc1c2c(n[nH]1)CC(C=C2)(C)C
|
|
55
|
c1cc2c(nc1)C(=O)c3ccc(cc3CC2)Cl
|
|
56
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
57
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
58
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
59
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
60
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
61
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
62
|
c1ccc2c(c1)c(=O)n(cn2)Cc3c(snn3)Cl
|
|
63
|
c1ccc2c(c1)[C@@H](C(=O)N2)c3c(cc(cn3)C(F)(F)F)Cl
|
|
64
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
65
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
66
|
COc1ccc2c(c1)occ(c2=O)c3ccon3
|
|
67
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
68
|
C(#N)c1c(n2c(c(nnc2n1)C(=O)N)N)C#N
|
|
69
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
70
|
COC1NC2CCCCC2NN1
|
|
71
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
72
|
c1ccc(cc1)Oc2c(c3ccccc3[nH]2)c4ccco4
|
|
73
|
C=c1/c(=C/c2ccccc2O)/c(=O)o[nH]1
|
|
74
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
75
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
76
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
77
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
78
|
Cc1cc(n(n1)c2nc3c(c4ccccc4[nH]3)nn2)C
|
|
79
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
80
|
c1ccc(c(c1)N)Sc2cc(nnc2Cl)Cl
|
|
81
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
82
|
CC1NC2C(S1)NC(NN2)C3CCCCC3
|
|
83
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
84
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
85
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
86
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
87
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
88
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
89
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
90
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
91
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
92
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
93
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
94
|
c1ccc(cc1)Sc2c3[nH]ncn3c(=O)nn2
|
|
95
|
c1cc(nnc1n2cncn2)[O-]
|
|
96
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
97
|
C[C@@H](c1nc2ccccc2o1)n3c4ccccc4nn3
|
|
98
|
c1ccc2c(c1)[C@@H]3Cc4cccnc4[C@]2(C3)O
|
|
99
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
100
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
101
|
|
|
102
|
|
|
103
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
104
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
105
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
106
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
107
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
108
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
109
|
Cc1c(sc(n1)c2c(n(nn2)c3ccccc3)C)C(=O)[O-]
|
|
110
|
CNC1C2C(C3CCCCC3S2)NNN1
|
|
111
|
|
|
112
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
113
|
CCNC(=O)Oc1c2ccccc2on1
|
|
114
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
115
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
116
|
c1ccc2c(c1)nnn2c3nnns3
|
|
117
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
118
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
119
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
120
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
121
|
Cc1c(cnc2c1c3cc(ccc3o2)O)C(=O)C
|
|
122
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
123
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
124
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
125
|
c1cnnc(n1)c2nccnn2
|
|
126
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
127
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
128
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
129
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
130
|
Cc1nnc-2n1C(Cc3c2cccc3)(C)C
|
|
131
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
132
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
133
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
134
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
135
|
Cn1c(=O)c2ccccc2nn1
|
|
136
|
Cc1cc(nc(n1)n2c3c(cn2)C(=O)CCC3)C
|
|
137
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
138
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
139
|
CCn1cc2c(n1)c(=O)n(nn2)C3CCCCC3
|
|
140
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
141
|
Cc1ccc(cc1)S(=O)(=O)Cn2cnnn2
|
|
142
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
143
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
144
|
c1cc(oc1)c2cn3c(n2)sc(n3)c4ccco4
|
|
145
|
Cn1c2c([nH]c1=O)nncn2
|
|
146
|
Cc1c(scn1)c2[n-]c3cc(cnc3n2)Br
|
|
147
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
148
|
CC1NCC2C(N1)N=C(NC2)C3CCC(CC3)CL
|
|
149
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
150
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
151
|
C1C[C@@H]2N=Cc3c(c(sc3N2C1)C(=O)N)N
|
|
152
|
Cc1c2c(n[nH]1)C=C(C[C@@H]2c3ccco3)c4ccco4
|
|
153
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
154
|
C1CCc2c(nc(nn2)N)C1
|
|
155
|
Cn1cc(c(c1[C@@H]2CCCO2)C(=O)[O-])c3ccccc3
|
|
156
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
157
|
c1c(nc[nH]1)C[C@@H]2C(=O)N3CCC[C@@H]3C(=O)N2
|
|
158
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
159
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
160
|
|
|
161
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
162
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
163
|
C1NC2C(S1)C(=O)[NH]C(N2)N
|
|
164
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
165
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
166
|
CO[C@@]1(CC(=O)N1c2ccccc2)n3c4ccccc4nn3
|
|
167
|
c1ccc2c(c1)nnn2S(=O)(=O)c3ccco3
|
|
168
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
169
|
COC(=O)Oc1c(c2c(s1)nc3ccccc3n2)N
|
|
170
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
171
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
172
|
CN(C)C1NC(SN1)C(=O)C2C[NH]C3C2CCCC3
|
|
173
|
Cc1c-2c(on1)CCc3c2n(nc3C(=O)[O-])C
|
|
174
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
175
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
176
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
177
|
C1C2CC3CC1CC(C2)C34C=C(N=C(N4)N)C(F)(F)F
|
|
178
|
|
|
179
|
c1ccc(c(c1)C2=N/C(=C/c3ccco3)/C(=O)N2)Cl
|
|
180
|
Cc1c(=O)n2ccccc2nn1
|
|
181
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
182
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
183
|
CC1(c2ccccc2NC(=O)c3c1cc(nn3)C(=O)OC)C
|
|
184
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
185
|
c1[nH]c(=O)c2c(n1)Oc3c(c(=O)[nH]cn3)C2
|
|
186
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
187
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
188
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
189
|
CC(=O)N1CCC(=CC1)c2c[nH]c3c2cccn3
|
|
190
|
C1CC2C(C(N[NH]C2=O)[O-])C1
|
|
191
|
[H]/N=c/1[nH]nc2c(n1)-c3ccccc3C2=O
|
|
192
|
C[C@@H]1CCc2c(c(on2)[C@@H]3CCCN(C3)C(=O)c4ccco4)C1
|
|
193
|
COC(=O)/C=C/C(=O)N2c3ccccc3[N-]C2=N1
|
|
194
|
CC(=O)N[C@@H]1[C@@H](S(=O)(=O)NC1=O)C2CCCCC2
|
|
195
|
c1ccc2c(c1)[nH]c(n2)[C@H](C#N)c3c(nc(c(n3)C#N)C#N)Cl
|
|
196
|
c1ccc(cc1)n2c(nnn2)Cn3c(nnn3)C4CCCC4
|
|
197
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
198
|
CC1(Nc2c(c3c(s2)CCCC3)-c4n1nnn4)C
|
|
199
|
c1cc2c(cc1C3CCCCC3)c4c([nH]2)C(=O)CC=C4
|
|
200
|
CC1(CC2=C(c3c1c[nH]n3)Sc4ccccc4N2)C
|
|
201
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
202
|
CC1=C[C@@H]2Cc3c(c(c4c(n3)oc(n4)C5CC5)N)[C@@H](C2)C1
|
|
203
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
204
|
Cc1cc(nc(n1)Nc2ncc(n2c3ccccc3)O)C
|
|
205
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
206
|
c1c2c(n[nH]c1=O)CCCC2
|
|
207
|
CNc1cnnc2c1cccc2
|
|
208
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
209
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
210
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
211
|
Cc1cc(nc(n1)Sc2ccc(nn2)Cl)C
|
|
212
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
213
|
|
|
214
|
c1cc(c(c(c1)Cl)N)c2c[nH]cc2Cl
|
|
215
|
CCCNC(=O)Cc1nc[nH]n1
|
|
216
|
c1ccc-2c(c1)CCc3c2nnn3c4ccc(cc4)Br
|
|
217
|
c1ccc(cc1)Oc2nc3ccc(nn3c(=O)n2)Cl
|
|
218
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
219
|
Cc1c(=O)n2c(nn1)N(CC2)C
|
|
220
|
COC(=O)c1c(cc(s1)n2cccn2)O
|
|
221
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
222
|
Cc1c2c(oc(c2c(nn1)C)C)C
|
|
223
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
224
|
c1cc(cc(c1)N/C=c/2ccc3c4c2cccc4c(=O)n3)C(=O)[O-]
|
|
225
|
c1ccc2c(c1)[C@H]3C[C@@H]([C@@H]2N3)c4ccc(nc4)Cl
|
|
226
|
CC1C(C2CC(CCN2N1)OC(=O)C)BR
|
|
227
|
c1cc(cc(c1)N)c2c3c(c4n2CCC4)c(=O)[nH]nc3[O-]
|
|
228
|
c1ccc2c(c1)c(=O)n(s2)c3nccs3
|
|
229
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
230
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
231
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
232
|
CC1=CC(NC(=O)N1c2ccccc2)(C)C
|
|
233
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
234
|
CCS(=O)(=O)c1ccc(c(c1)n2c(c[nH]c2=O)O)OC
|
|
235
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
236
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
237
|
c1ccc2c(c1)c3c([nH]2)nc4c(n3)non4
|
|
238
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
239
|
c1c2c(nc(n1)N)CCOC2
|
|
240
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
241
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
242
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
243
|
c1cc(oc1)c2c3c(c4c(n2)C=C[C@@H]5[C@@H]4C=CC=C5)CCC3
|
|
244
|
CC1=C2[C@@H](C(C=C2[C@@](C(=O)C13CC3)(C)O)(C)C)O
|
|
245
|
c1cc(ncc1C#N)Sc2nccs2
|
|
246
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
247
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
248
|
C[C@@]12CC(=O)N(C1=CCc3c2ncs3)C
|
|
249
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
250
|
c1ccc2c(c1)Nc3c(cc(nn3)Cl)S2
|
|
251
|
c1cc2c(nc1)Nc3c(cccn3)O2
|
|
252
|
c1cc2c(nc1)nc(s2)Cl
|
|
253
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
254
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
255
|
|
|
256
|
Cc1cc(=O)oc2c1c(n[nH]2)C
|
|
257
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
258
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
259
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
260
|
CCOc1nnc(s1)CN2CCOCC2
|
|
261
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
262
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
263
|
Cc1c(c(n[nH]1)n2cnnc2)c3ccc(cc3)OC
|
|
264
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
265
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
266
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
267
|
c1c2c(n[nH]1)[C@H]3[C@@H]([C@@H](C2=O)CC3=O)NCCC#N
|
|
268
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
269
|
Cc1cc(nc2c1c3c(o2)C(=O)N(CC(=O)N3)c4ccccc4)C
|
|
270
|
C[C@@]1(COC(=O)N1)[C@@H]2CCc3cc(ccc3C2)O
|
|
271
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
272
|
c1cc(c(c2c1nccn2)Br)N=C3NCCN3
|
|
273
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
274
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
275
|
Cc1cc(n(n1)c2nc(c(nn2)C)[O-])C
|
|
276
|
Cc1ccc2c(c1)nnc(n2)N
|
|
277
|
c1ccc2c(c1)nnn2n3c4ccccc4nn3
|
|
278
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
279
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
280
|
C1CCC2C(C1)C=CC23C(=O)C4CCCCC4C3=O
|
|
281
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
282
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
283
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
284
|
Cc1nnc(s1)Sc2cc(nc(n2)N)Cl
|
|
285
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
286
|
Cc1cc2c([nH]1)ccc3c2non3
|
|
287
|
Cc1c(oc(n1)Cn2c(=O)c3ccccc3nn2)C
|
|
288
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
289
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
290
|
c1cnccc1c2nnc3n2CCC3
|
|
291
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
292
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
293
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
294
|
c1cc2cn[nH]c2cc1C3=CCOCC3
|
|
295
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
296
|
Cc1nc2c3c(sc2c(=O)o1)N4CCC[C@@H]4N=C3
|
|
297
|
C[C@@H]1CCCC2=C1[C@@H](C3C(CCCC3N)[C@@H]2O)O
|
|
298
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
299
|
CCc1c(nnc(c1C#N)[O-])CC
|
|
300
|
CC1(/C(=C(Nc2ccccn2)/O)/C(=O)c3ccccc3S1)C
|
|
301
|
c1ccc(cc1)[C@@H]2C=CC3(C2(C#N)C#N)OCCCO3
|
|
302
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
303
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
304
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
305
|
c1ccc(c(c1)c2nc([nH]n2)CC(=O)[O-])O
|
|
306
|
Cc1c2c(ncnc2on1)N
|
|
307
|
C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NCCCc4[n-]nnn4)C
|
|
308
|
CC(=O)N1CCCn2c1nnc2SC
|
|
309
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
310
|
c1ccc2c(c1)[nH]c(=O)n2c3csc(n3)c4ccncc4
|
|
311
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
312
|
|
|
313
|
Cc1c(c2c(c(c1N)C)[C@@H](C(O2)(C)C)c3cccnc3)C
|
|
314
|
c1cc(cc(c1)C(F)(F)F)c2ccc(o2)c3csnn3
|
|
315
|
c1cc2c(cc1C(F)(F)F)ncc3c2sc4nncn4c3=O
|
|
316
|
C(c1c(non1)N)c2c(non2)N
|
|
317
|
C/C(=Nc1ccccc1)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
318
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
319
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
320
|
|
|
321
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
322
|
COC(=O)CC1(C(=O)NC(=O)N=C1[O-])CC(=O)OC
|
|
323
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
324
|
Cn1c(=O)n2cnc(c2nn1)C#N
|
|
325
|
C[S@@](=O)c1ccc(nn1)n2cccc2
|
|
326
|
CC(C)n1c2c(nn1)CCCC2
|
|
327
|
CNC(=O)N=c1c(=O)c2ccccc2c1=O
|
|
328
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
329
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
330
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
331
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
332
|
CN1CC[C@@H](c2c1cccc2)n3c4ccccc4nn3
|
|
333
|
C1C(C(C2C(C1F)N[NH]N2)N)F
|
|
334
|
CC1(C=C(c2cnccc2O1)N3CCCC3=O)C
|
|
335
|
c1ccc(cc1)Sn2c3ccccc3nn2
|
|
336
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
337
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
338
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
339
|
c1ccc2c(c1)ncn2c3c(nns3)C(=O)N
|
|
340
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
341
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
342
|
c1ccn(c1)c2c(c3c(s2)CN(CC3)c4cccc(n4)F)C#N
|
|
343
|
c1ccc2c(c1)c3ccc(cc3o2)n4ncnn4
|
|
344
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
345
|
Cc1ccc(cc1)n2c(c(nn2)C(=O)n3c(cc(n3)C)C)C
|
|
346
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
347
|
CSc1c-2c(cs1)CCc3c2n[nH]c3
|
|
348
|
c1cc(cnc1)NCc2csnn2
|
|
349
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
350
|
Cc1nnc(n1C)Sc2c(c3ccccc3[nH]c2=O)NC4CC4
|
|
351
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
352
|
CS(=O)(=O)NC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
353
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
354
|
c1cc2c(cc1O)occ(c2=O)c3cnc[nH]3
|
|
355
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
356
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
357
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
358
|
CSc1nc(c(n1Cc2ccco2)C#N)N
|
|
359
|
c1ccc2c(c1)nc3n2C(=O)CC(=N3)[O-]
|
|
360
|
c1cc(sc1)CCNc2ncccn2
|
|
361
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
362
|
c1ccc2c(c1)c(=O)n3c4ccccc4oc3n2
|
|
363
|
C1Cc2c3c(nnc4c3c(nn2)CCC4)C1
|
|
364
|
c1ccc2c(c1)-c3cccnc3C2=O
|
|
365
|
Cc1c(=O)n2c(nn1)N(CCC2)C
|
|
366
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
367
|
c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
|
|
368
|
|
|
369
|
CCCCc1ncc(n1C(=O)C)COC(=O)C
|
|
370
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
371
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
372
|
c1ccc(c(c1)C(=O)[C@@H]2C(=NN=N2)C(F)(F)F)O
|
|
373
|
CSc1c2ccccc2nnn1
|
|
374
|
c1ccc2c(c1)/C(=N/c3ccccn3)/C(=O)N2
|
|
375
|
Cc1cc(c2nncn2n1)n3cc(c(=O)[nH]c3=O)F
|
|
376
|
CN1[C@@H]([C@H](CC1=O)c2ccccc2)[C@H](C#Cc3ccccn3)O
|
|
377
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
378
|
c1cc(c2c(c1O)[C@@H]3CC[C@H]2C=C3)O
|
|
379
|
c1c[nH]nc1C2CCCCC2
|
|
380
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
381
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
382
|
COC1CCC(CC1)C2NNC3N2SC4C3CCCC4
|
|
383
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
384
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
385
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
386
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
387
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
388
|
CN(C)C1=[NH+]C=CC(=CC1)c2ccccc2
|
|
389
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
390
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
391
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
392
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
393
|
c1ccc2c(c1)c(=O)c(c([nH]2)[O-])C(=O)Nc3nccs3
|
|
394
|
CC1(C=CN(C(=O)O1)c2ccccc2)C
|
|
395
|
CSc1/c(=CN)/n2cnnc2n1
|
|
396
|
c1ccc(cc1)c2cc(no2)c3c(non3)N
|
|
397
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
398
|
c1ccc(cc1)C(=O)/N=c/n3c(ns2)-c4ccccc4C3
|
|
399
|
CC1NC2C(CN(N2)CC3CCCCC3)C(=O)O1
|
|
400
|
c1ccc2c(c1)c(c3ccccc3n2)Nn4cnnc4
|
|
401
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
402
|
c1ccc2c(c1)[nH]/c(=N/C3=NC(=O)C[C@@H](N3)C(=O)[O-])/s2
|
|
403
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
404
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
405
|
Cc1cc(=O)c2c(o1)cc3c(c2O)CC=C(CO3)C
|
|
406
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
407
|
CN1C(NCN1)CCC2CCCCC2
|
|
408
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
409
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
410
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
411
|
c1csc2c1c(n[nH]c2=O)N
|
|
412
|
C[C@@H]1C=C([C@H]2C(=N[NH+]=C2N1)c3ccccc3)C
|
|
413
|
COC1CCC(CC1)/C=C/2C(=C)[NH]N(C2=O)CC3CCCCC3
|
|
414
|
Cc1cc(nc(n1)Nn2c(cc(c(c2=O)C(=O)C)[O-])C)C
|
|
415
|
c1cc2c(cc1c3c4ccoc4ccn3)OCCO2
|
|
416
|
c1ccc(cc1)[C@@H]2CC(=O)Nc3c2snc3C(=O)[O-]
|
|
417
|
CSC1C2C3C(C(NNN3)CL)SC2NS1
|
|
418
|
Cc1c2c(nc(n1)N)OCC2
|
|
419
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
420
|
c1ccc2c(c1)Cc3cccnc3O2
|
|
421
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
422
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
423
|
CCSc1nnc2n1CCN2c3ccccc3
|
|
424
|
CC(C)(C)C(=O)CC1=NC(=O)/C(=Cc2csnn2)/S1
|
|
425
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
426
|
Cn1c2c(cn1)nnn(c2=O)c3ccccc3
|
|
427
|
CC(C)(C)c1c2c(no1)-c3ccccc3C2=O
|
|
428
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
429
|
CN1CCn2c3ccccc3nc2C1
|
|
430
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
431
|
Cc1cccc(n1)C#CCNc2ccccc2
|
|
432
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
433
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
434
|
C1CCC2C(C1)CC[C@@H]2CC3CCCCN3
|
|
435
|
CS(=O)(=O)c1cccnn1
|
|
436
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
437
|
c1cnn(c1)Cc2nnc3n2CCC3
|
|
438
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
439
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
440
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
441
|
c1ccc2c(c1)Nc3c(cccn3)S2
|
|
442
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
443
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
444
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
445
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
446
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
447
|
C1NC([NH]N1)NC2=NCCO2
|
|
448
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
449
|
Cc1cc(nc(n1)SN2CCCCC2)C
|
|
450
|
Cc1nc-2c(s1)Cc3c2ccc(c3)OC
|
|
451
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
452
|
|
|
453
|
Cc1ccc(nc1)N[C@@]2([C@@H](C(=NC2=O)C)C#N)C(F)(F)F
|
|
454
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
455
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
456
|
C1CCC(C(C1)C2=C/C(=C/3C=CC=CC3=O)/C=NN2)O
|
|
457
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
458
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
459
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
460
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
461
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
462
|
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
|
|
463
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
464
|
CSc1nnc(o1)Cn2cnc(c2Cl)Cl
|
|
465
|
|
|
466
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
467
|
C1CCC2C(C1)-C3CCCCC3[C@H]4[C@@H]2CC(=O)O[C@@H]4C(=O)[O-]
|
|
468
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
469
|
C1CCC2C(C1)NC3=C(N2)O[C@@H](C3=O)C4CCCO4
|
|
470
|
c1ccc(cc1)N2Cc3nc(=O)[nH]n3C2=O
|
|
471
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
472
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
473
|
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1
|
|
474
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
475
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
476
|
CC1(CO/C(=Nc2ccc(cc2)Cl)/N1)C
|
|
477
|
c1cnn(c1)c2ccc(cc2)c3cnco3
|
|
478
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
479
|
CC(C)(C)C(=O)[C@@]1([C@@H](c2ccccc2O1)O)n3cncn3
|
|
480
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
481
|
Cc1[nH]nc(n1)c2ccccc2
|
|
482
|
|
|
483
|
c1ccc-2c(c1)CSc3c2[nH]nc3O
|
|
484
|
c1ccnc(c1)Nc2nsc(=O)n2c3ccccn3
|
|
485
|
Cn1c2ccccc2n3c1n[nH]c3=O
|
|
486
|
c1ccc2c(c1)c(nnn2)Nc3ccccc3Cl
|
|
487
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
488
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
489
|
CCn1c2c(c(=O)n3c1c(cn3)C(=O)[O-])CN(CC2)C
|
|
490
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
491
|
CCCn1c(n[nH]c1=O)c2cccs2
|
|
492
|
C[C@@H]1CC2=C(C=Nc3ccccc3N2)C(=O)C1
|
|
493
|
CS(=O)(=O)/N=C(/c1ccc(nc1)C(=O)[O-])[O-]
|
|
494
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
495
|
CNC1=[NH+][C@@H](N(S1)c2ccccc2)c3ccccc3
|
|
496
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
497
|
c1cc2c(c3c1non3)nns2
|
|
498
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
499
|
CSc1nc2c(cc(s2)c3ccccc3)nn1
|
|
500
|
c1c(cnc2c1COC(=O)N2)Br
|
|
501
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
502
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
503
|
Cc1c(nnn1c2ccsc2C(=O)OC)C(=O)C
|
|
504
|
c1cc(ccc1c2c(c[nH]n2)N3C=CCCC3=O)Cl
|
|
505
|
c1ccnc(c1)n[nH]/c2=NC(=O)C3CC3
|
|
506
|
COC(=O)c1csc2c1nns2
|
|
507
|
c1cc(ccc1N2C3=CCCCC3=C(C2=O)O)Cl
|
|
508
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
509
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
510
|
c1cc(cc(c1)n2c(c(n(c2=O)C3CC3)[O-])[O-])N
|
|
511
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
512
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
513
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
514
|
Cc1c(nnn1C)c2csnn2
|
|
515
|
c1ccc(cc1)N2[C@H]3C[C@@H]4[C@@H]2[C@@H](CC3=O)c5c4cccc5
|
|
516
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
517
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)no2
|
|
518
|
COC(=O)Cc1cccnn1
|
|
519
|
C1Cc2c(nnc(c2C(F)(F)F)[O-])C1
|
|
520
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
521
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
522
|
c1ccc(cc1)Cn2c(nnc2Cl)C3CC3
|
|
523
|
CN1C=NC2C(NCN2[C@@H]3CC[C@@H](O3)CO)[C@@H]1O
|
|
524
|
CC(C)(C)[S@@](=O)OC12CC3CC(C1)CC(C3)C2
|
|
525
|
Cc1c2c(nc(n1)C)Oc3ccc4ccccc4c3C2
|
|
526
|
[H]/N=c/n2c3ccccc3[nH]c(=O)c2c(s1)c4ccccc4
|
|
527
|
c1ccc(cc1)C(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
528
|
C1CCC2C(C1)C(NO2)C[S@@](=N)(=O)[O-]
|
|
529
|
CN1CC(=O)N=C1/N=C(/C23CC4CC(C2)CC(C4)C3)[O-]
|
|
530
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
531
|
c1ccc(cc1)c2nc(on2)c3csnn3
|
|
532
|
Cc1cn2c(nc1=O)O[C@@H]3C[C@H]2O[C@@H]3CO
|
|
533
|
Cc1nc(cn1C)S(=O)(=O)Oc2ccccc2F
|
|
534
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
535
|
c1ccc(cc1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)[C@@H]4OC[C@H]3O4
|
|
536
|
COc1cc(cc(c1OC)OC)c2cc(=O)[nH]c(=O)[nH]c2=O
|
|
537
|
Cc1c2c(n3c(n1)nnn3)CCC2
|
|
538
|
c1ccc2c(c1)c(c3c(n2)C[C@@H]4CCCN3C4)C(=O)[O-]
|
|
539
|
c1ccc2c(c1)c(=O)n(nn2)Cn3c(=O)oc(n3)c4cccs4
|
|
540
|
CN1c2ccccc2Oc3c1cc(nn3)Cl
|
|
541
|
c1c(cn[nH]1)CS(=O)(=O)N
|
|
542
|
CC1(COC(=O)C(=C1C(=O)[O-])C(=O)[O-])C
|
|
543
|
COCCSc1nnc(n1C2CC2)c3c[nH]c4c3cccc4
|
|
544
|
c1ccc2c(c1)cc3n(c2=O)CCCCC3
|
|
545
|
CCOc1nc(nc(n1)N)C
|
|
546
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
547
|
CC(=O)NC1=N[C@@]2([C@@H](c3ccccc3[C@@]2(N1)O)O)O
|
|
548
|
CCNc1nc(nc(n1)Sc2ccc(cc2)C(=O)OC)N
|
|
549
|
c1ccc2c(c1)c3n(n2)C(=O)c4ccccc4C3=O
|
|
550
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
551
|
|
|
552
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
553
|
Cc1ccc(cc1)/N=c/2c3c[nH]nc3[nH]cn2
|
|
554
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
555
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
556
|
|
|
557
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
558
|
Cc1nc(no1)c2cc(sc2)S(=O)(=O)NC3CC3
|
|
559
|
CCOC(=O)C1=C2C(=C(C(=N2)O)C(=O)OCC)N=C1O
|
|
560
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
561
|
Cc1c(=O)n2c(nn1)SCC(=N2)N
|
|
562
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
563
|
Cc1[nH]c(=O)cc(n1)CSc2ccccc2
|
|
564
|
Cc1c(nccn1)c2ccn[nH]2
|
|
565
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
566
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
567
|
CC[C@@H]1C2CC-3N(C(=O)C2COC1=O)CC4C3CCCC4
|
|
568
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
569
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
570
|
c1cc(cc(c1)N)c2cocn2
|
|
571
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
572
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
573
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
574
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
575
|
CC1NC2C(NCNC2NN1)N
|
|
576
|
Cc1cc(c(nn1)N)C(=O)N
|
|
577
|
Cc1csc(n1)Sc2nc(ns2)Cl
|
|
578
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
579
|
c1ccn(c1)c2ccc(nn2)Cl
|
|
580
|
CN(CC(=O)[O-])c1ncc2c(n1)C=CCC2
|
|
581
|
[H]/N=C/N/C(=Nc2ccc(c(c2)F)F)/NC(N1)(C)C
|
|
582
|
C1C[C@@H]2C[C@H]1[C@@H]3C2=Cc4c([nH]c(=O)s4)S3
|
|
583
|
C1CCn2c(nnc2CC#N)C1
|
|
584
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
585
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
|
586
|
Cc1csc(n1)c2nnc(o2)N
|
|
587
|
c1ccc(cc1)[C@@H]2NC(=[NH2+])Nc3n2c4ccccc4n3
|
|
588
|
CC1(O[C@@H]2[C@@H]3C=C[C@H]([C@@H]2O1)C(=C3C(=O)[O-])C(=O)OC)C
|
|
589
|
CC1=CC=C2C3CCCCC3C=CN2C(=O)C1
|
|
590
|
c1cc2c(nc1)S[C@@]3(C2=O)CCOC3=O
|
|
591
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
592
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
593
|
c1cc2c(nc1)nsc2Br
|
|
594
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
595
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
596
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
597
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
598
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
599
|
Cn1c(c(c(=O)[nH]c1=O)Sc2nc3ccccc3s2)N
|
|
600
|
c1ccnc(c1)SCc2c(snn2)Cl
|
|
601
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
602
|
Cc1cs/c(=N/c2c(nc[nH]2)C(=O)N)/n1c3ccccc3
|
|
603
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
604
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
605
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
606
|
C1CO[C@@H]2C=c3c(=C[C@H]2O1)nc(c(n3)Cl)Cl
|
|
607
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
608
|
c1ccc2c(c1)nnn2c3ccco3
|
|
609
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
610
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3c(=O)ccc(n3)c4ccco4
|
|
611
|
Cc1[nH]c(=O)c2c(n1)CCC2
|
|
612
|
COc1c2cn[nH]c2ncn1
|
|
613
|
Cn1c(cc(n1)c2ccccc(=O)c2[O-])C(=O)[O-]
|
|
614
|
c1ccc2c(c1)nc3n2[C@@H](NC(=[NH+]3)N)c4ccco4
|
|
615
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
616
|
CCCSc1c(nns1)C
|
|
617
|
c1cc2c(=O)[nH]nc(n2c1)[O-]
|
|
618
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
619
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
620
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
621
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
622
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
623
|
c1(nnc(s1)C(=O)N)C(=O)N
|
|
624
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
625
|
Cc1cc(nc2c1c(c(o2)C(=O)C)N)C
|
|
626
|
CC(=O)n1c(c(nn1)CC#N)c2ccccc2
|
|
627
|
CC1(CCc2c(ccc3c2cc(o3)c4ccccn4)O1)C
|
|
628
|
CC(=O)c1ccc(c(c1)F)Sc2nncs2
|
|
629
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
630
|
Cc1c(nc([nH]1)c2[nH]c(c(n2)C)C)C
|
|
631
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
632
|
Cc1nc(cs1)c2nnc(o2)N
|
|
633
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
634
|
Cn1c(nnc1Sc2cnccn2)c3ccc(cc3)F
|
|
635
|
Cc1cnc(s1)Nc2cnc(nc2)SC
|
|
636
|
C1C2=C[C@@H]3C=C[C@H]2[C@@H](C=C3)NC1=O
|
|
637
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
638
|
Cc1[nH]c(c(n1)[C@@H](c2ccc(cc2)F)C(C#N)C#N)[O-]
|
|
639
|
Cc1c(nn2cc(nc2n1)c3ccccc3)C
|
|
640
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
641
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
642
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
643
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
644
|
c1ccc2c(c1)ccn2Cc3cnc(s3)Cl
|
|
645
|
c1cc(oc1)c2cn3c4ccc(c(c4n5c3c2CCCC5)F)F
|
|
646
|
CCOC1C-2C(NC(N1)N)CCC3C2CCCC3
|
|
647
|
CCN1C(NN2C(C1=O)NC3CCCCC3C2=O)C
|
|
648
|
c1c(c(nc(=O)n1N2CCCCC2)[O-])C#N
|
|
649
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
650
|
CCCCc1c2c(n[nH]1)CC(CC2=O)(C)C
|
|
651
|
c1cc2c(cc1C(F)(F)F)nc(s2)c3csnn3
|
|
652
|
c1c(c(sc1Cl)Cl)C2=NCCNC2=O
|
|
653
|
Cc1c(c(on1)N)C2=CCCCC2
|
|
654
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
655
|
c1cc2c(cc1N)N3CC[NH+]=C3S2
|
|
656
|
c1ccc(cc1)c2cn(nn2)c3ccccc3
|
|
657
|
c1ccc(c(c1)Nc2c(c(c(c3n2nnn3)C#N)Cl)Cl)F
|
|
658
|
c1ccc(cc1)Nn2c3ccccc3nn2
|
|
659
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
660
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
661
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
662
|
CN1C(=O)C(C(CN1)SC2NC3CCCCC3S2)CL
|
|
663
|
c1ccc2c(c1)nc(s2)Nc3c(=O)c(nsn3)Cl
|
|
664
|
c1cc2c(cc1c3nccs3)CC=C2
|
|
665
|
c1ccc(cc1)[C@H]2C[C@](N=C(N2)N)(C(F)(F)F)O
|
|
666
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
667
|
Cc1c(nnn1c2ccccc2)S(=O)(=O)c3ccccc3
|
|
668
|
COC(=O)[C@@H]1CC2CNCN2C(=O)N1
|
|
669
|
CC1=Cn2c3ccccc3nc2CO1
|
|
670
|
c1c2c(n[nH]c1=O)CCOC2
|
|
671
|
Cn1c(cc(n1)Oc2ccc(cn2)C(F)(F)F)C(F)(F)F
|
|
672
|
c1ccc(cc1)n2c(nnc2[O-])c3cccnc3
|
|
673
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
674
|
CN1[C@@H](C(=O)N=C1N)[C@@]2(c3ccccc3NC2=O)O
|
|
675
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
676
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
677
|
CCn1c2c(con2)c(=O)[nH]c1=O
|
|
678
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
679
|
c1ccc2c(c1)Nc3cc(nnc3S2)Cl
|
|
680
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
681
|
|
|
682
|
C1CC2N(C1)-C3C(CCS3)CN=C2
|
|
683
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
684
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
685
|
Cc1cc(=O)n2n1c3ccccc3nn2
|
|
686
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
687
|
c1ccc2c(c1)-n3c(n[nH]c3=O)CS2
|
|
688
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
689
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
690
|
c1ccc2c(c1)CNC(=O)CS2
|
|
691
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
692
|
|
|
693
|
C/C(=C/CO)/C#CCN1CCCC1
|
|
694
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
695
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
696
|
Cc1c2c([nH]n1)NC3=C([C@@H]2C)C(=O)OC3
|
|
697
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
698
|
c1ccc(cc1)C(=O)N2CCC3=CC(=O)O[C@@H]3C2
|
|
699
|
|
|
700
|
|
|
701
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
702
|
c1cc(sc1)c2c(c(oc2c3cccs3)N)C#N
|
|
703
|
CC1=CC(=C(O[C@@H]1c2cccnc2)C)C(=O)OC
|
|
704
|
CC(C)c1c(cn(n1)C)c2[nH]c3cc(cnc3n2)Br
|
|
705
|
c1cnc(c(n1)C(=O)[C@@H]2CCOC2)Cl
|
|
706
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
707
|
CC1=C(NC(=O)[C@@H](NC1=O)c2ccccc2)C
|
|
708
|
CC1NC(NO1)C2CN3C(C2C(C)C)C(=O)NC[NH]3
|
|
709
|
c1ccc(cc1)c2nnc3n2CCCC3
|
|
710
|
Cc1ccc(c(n1)N)Cn2c(c(sc2=O)CCO)C
|
|
711
|
COCCn1c(=O)c2c(nn1)scn2
|
|
712
|
C1CCC2C(C1)CC3CCCC4C3[C@@H]2N=C4
|
|
713
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
714
|
COc1cccc(n1)[C@H]2CCC(=O)NC2
|
|
715
|
Cc1nc2c(ncnc2o1)N
|
|
716
|
CNC1CNC2CCCCC2N1
|
|
717
|
C1CCC2C(C1)[C@@H](CCS2)NC3CNCC(N3)CL
|
|
718
|
c1ccc(cc1)Cn2c(c(nn2)c3[nH]c4ccccc4n3)N
|
|
719
|
c1ccc2c(c1)nc3c(c(oc3n2)N4CCCC4)C#N
|
|
720
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
721
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
722
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
723
|
c1cc(nc2c1n[n-]n2)Cl
|
|
724
|
c1ccc(cc1)c2nc(cs2)c3ccn[nH]3
|
|
725
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
726
|
c1ccc2c(c1)c-3c4c(nc(=[NH2+])c3c(o2)O)CCCCC4
|
|
727
|
c1ccc2c(c1)nnn2C3=CCCO3
|
|
728
|
Cc1nnc(s1)N2CCOC2=O
|
|
729
|
|
|
730
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
731
|
C1CNNCC1CCC(=O)[O-]
|
|
732
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
733
|
Cc1c(c(n[nH]1)O)[C@@H](c2ccco2)C(C#N)C#N
|
|
734
|
Cc1c(c(sn1)C)Nc2c(c(ncn2)SC)C#N
|
|
735
|
C#CCn1cnc2c1cccc2
|
|
736
|
C[C@@]1(C[C@@H](NN2C3CCCCC3C4C2C1CCC4)CO)CO
|
|
737
|
c1ccc2c(c1)ncc3n2ncc3
|
|
738
|
CC1CCC2C(C1)NNS2
|
|
739
|
c1c2c(cnc1Cl)CCN2
|
|
740
|
Cc1nc(nc(=O)n1c2ccccc2)Nc3ccccc3
|
|
741
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
742
|
c1cc(ccc1[C@@H]2C=Cc3cc(cnc3O2)Cl)Cl
|
|
743
|
CCOC(=O)c1[nH]nc(n1)N
|
|
744
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
745
|
Cc1cc([nH]c(=O)c1C2=CC(=NCCN2)C(F)F)C
|
|
746
|
CCNc1nc2c(s1)c(c(c(n2)N)C#N)c3ccccc3
|
|
747
|
c1c(c2c(nncn2n1)[O-])Cl
|
|
748
|
Cc1cc(no1)CS(=O)(=O)NC
|
|
749
|
CCSc1ccc(nn1)N
|
|
750
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
751
|
C=CCn1cc(ccc1=O)c2ccco2
|
|
752
|
C[C@@]12CC(=N[C@@H]1NC(=O)C2)c3ccccc3O
|
|
753
|
COC1(c2c(non2)CC[C@@H]1O)OC
|
|
754
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
755
|
COc1c(cc2c-3c1COc4c3c(cc(c4)O)CC2)O
|
|
756
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
757
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
758
|
c12c([nH]c(=O)nc1onn2)[O-]
|
|
759
|
|
|
760
|
CC(=O)Nc1c(c(cs1)C2=C[C@@H]3[C@@H](C=C2)OCO3)C#N
|
|
761
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
762
|
C1CCC(CC1)COC(=O)N2C[C@@H]3CC[C@H]2CC(=O)O3
|
|
763
|
C[C@@]1(C(OC(=O)N1CCc2ccco2)(C)C)O
|
|
764
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
765
|
c1cc(nn2c1nnn2)n3ccnc3
|
|
766
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
767
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
768
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
769
|
CSc1c(c([nH]n1)c2ccco2)C#N
|
|
770
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
771
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
772
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
773
|
Cc1c(n2c(ncn2)nn1)[O-]
|
|
774
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
775
|
c1ccc(cc1)[C@@]2(C=C(C(=O)O2)O)O
|
|
776
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
777
|
CCCCSc1nc(c2nc3ccccc3c(=O)n2n1)[O-]
|
|
778
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
779
|
c1c(=O)[nH]c2c(n1)CCCC2
|
|
780
|
CC1=CC(=O)Nc2c(cccn2)O1
|
|
781
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
782
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
783
|
CC=C(C(=O)N/C1=C/c2ccccn2)C
|
|
784
|
CC1(Cc2ccccc2-c3n1c4c(c3)nc5ccccc5n4)C
|
|
785
|
COc1cc(=O)nc(o1)c2ccco2
|
|
786
|
c1ccc2c(c1)CN(C(=C2)N)C3CCCCC3
|
|
787
|
Cn1cc(cn1)c2cc(on2)CO
|
|
788
|
c1ccc2c(c1)ccc3c2CCc4c(c(co4)C(=O)N)C3=O
|
|
789
|
c1ccc2c(c1)CCC3=C(CC2=O)C(=O)OC3
|
|
790
|
|
|
791
|
Cc1cc(c(nn1)C)SC
|
|
792
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
793
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
794
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
795
|
c1c(c2c(nc[nH]2)nn1)Cl
|
|
796
|
CC(=O)Nc1nnc(s1)c2c(non2)N
|
|
797
|
C1Cc2c(onc2c3c4c(on3)CCC4)C1
|
|
798
|
C1CCC2C(C1)CCC3C(C4CCCCC4[NH]3)C2
|
|
799
|
c1ccc2c(c1)[C@@H]3N(C2=O)c4ccccc4S3
|
|
800
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
801
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
802
|
C1=N[C@@H]2C(=N1)N=C(N=C2Cl)N
|
|
803
|
COC(=O)/C=c/c(=O)[nH]c(=C)s1
|
|
804
|
CC1=NC2=NC(=NC(=O)C2=C1Sc3ccccn3)[NH-]
|
|
805
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
806
|
c1c2n(cn1)[C@@H](CCC2)CCCC#N
|
|
807
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
808
|
CC1=C([C@@]2(C(=O)c3ccccc3[C@@]2(N1)O)O)C(=O)C
|
|
809
|
CCNC(=O)Nc1nc2cc(ccn2n1)c3cccnc3
|
|
810
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
811
|
[H]/N=C/N/C(=Nc2ccccc2Cl)/NC(N1)(C)C
|
|
812
|
|
|
813
|
c1ccc2c(c1)c(=O)c(=Nc3[n-]nnn3)c2=O
|
|
814
|
c1ccnc(c1)C#CCN2CCCCC2
|
|
815
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
816
|
C1CCC(CC1)n2c(=O)c3c([nH]c2=O)C=CC3
|
|
817
|
Cc1nc2c(c(=O)n1N)OC3=C(S2)CCCC3
|
|
818
|
c1cnn(c1)c2cncc(n2)Cl
|
|
819
|
c1ccc2c(c1)CCNC(=O)C(=O)N2
|
|
820
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
821
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
822
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
823
|
C#Cc1cc2ccccc2nc1
|
|
824
|
c1ccc(cc1)[C@@H]2[C@@H]([C@@H](OC3=C2CCCC3)N)C#N
|
|
825
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
826
|
c1cc(oc1)Cn2c(=O)c3cnc(nc3nc2[O-])n4ccnc4
|
|
827
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
828
|
Cc1c(=O)n2c(=O)cc(sc2nn1)C(=O)OC
|
|
829
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
830
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
831
|
c1cc(oc1)c2cc(=O)n3cnnc3s2
|
|
832
|
Cc1cc(nc(n1)Sc2nc(nc(n2)Cl)NC)C
|
|
833
|
CCSc1nncn1Cc2ccco2
|
|
834
|
Cc1c(non1)OCCOc2c(non2)C
|
|
835
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
836
|
c1cc(cc(c1)N)C2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
837
|
C1CNC2C3CNC4C(C3NN2C1)CCS4
|
|
838
|
c1ccc2c(c1)c(=O)n3n2C[C@@H](C3)O
|
|
839
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
840
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
841
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
842
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
843
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
844
|
COC(=O)C1=Nn2c3ccccc3nc2CC1
|
|
845
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
846
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
847
|
CN1[C@@H]2C=C[C@H](C1=O)C3C2CCCC3
|
|
848
|
Cc1cnc(nc1c2ncnn2C)N
|
|
849
|
Cc1cc(nc2c1c(n[nH]2)S(=O)(=O)N3CCC(CC3)C)C
|
|
850
|
|
|
851
|
CS(=O)(=O)c1c(c(on1)c2cccs2)C#N
|
|
852
|
c1ccc(cc1)N=c2c(=O)c3ccccc3c2=O
|
|
853
|
CC1C(SC(N1)C[C@@H](C)N2CC(CN2)CL)C(=O)C
|
|
854
|
Cn1c(=O)c(nn(c1=O)C)Oc2ccc3c(c2)OCO3
|
|
855
|
CCCCc1[nH]cc([nH+]1)CO
|
|
856
|
CCc1cnnn1c2c(non2)N
|
|
857
|
c1cc2cccc3c2c(c1)C4=NS(=O)(=O)N=C34
|
|
858
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
859
|
C[C@]1(c2ccccc2O[C@H]1n3c4ccccc4nn3)CO
|
|
860
|
CN1CNC2C1NNNC2[O-]
|
|
861
|
C1CCC2C(C1)CC[C@@H]3N2[C@@H]4C5CCCCC5C(=O)N4CC3
|
|
862
|
c1ccc(cc1)n2c(=O)cc3n(c2=O)CCN3
|
|
863
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
864
|
CCN(CC)/C(=C/C(=O)OCC)/C1CC([NH]C1C)C
|
|
865
|
Cc1cc(c(c(=O)n1c2nnns2)C(=O)C)[O-]
|
|
866
|
CC(C)(C)C(=O)OCSc1nc(no1)c2cccnc2
|
|
867
|
c1ccc(cc1)N2CC(=C(N)N)C(=NC2=O)[O-]
|
|
868
|
c1ccc2c(c1)nc3c(n2)Oc4ccccc4N3
|
|
869
|
CCCO[C@@H]1CCCN(C1)C(=O)c2ccnnc2
|
|
870
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
871
|
c1ccc-2c(c1)CCc3c2cn[nH]3
|
|
872
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
873
|
c1cc2c(nc1)onc2Cl
|
|
874
|
c1ccc2c(c1)c3c(cc(nc3[nH]c2=O)C(F)(F)F)c4ccco4
|
|
875
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
876
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
877
|
C[C@@]1(C(=O)N=C2N1C=CC=C2)CC(=O)[O-]
|
|
878
|
c1ccc(cc1)c2c(=O)c3cscc3[nH]c2[O-]
|
|
879
|
c1ccc2c(c1)ncn2n3cccc3
|
|
880
|
CN1C(=O)C(=C(C12CCCC2)N)C(=O)N
|
|
881
|
c1ccc2c(c1)Nc3c(sc(=O)[nH]3)C=N2
|
|
882
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
883
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
884
|
c1ccn(c(=O)c1)OCC(=O)[O-]
|
|
885
|
c1ccc(cc1)C(=O)Nc2cc[nH]n2
|
|
886
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
887
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
888
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
889
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
890
|
CC1=C(C(=O)NC1)c2ccccc2
|
|
891
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
892
|
C=CC[C@@H]1C(=NC(=NC1=O)N)O
|
|
893
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
894
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
895
|
CCc1ccc(s1)Nc2ncnc(n2)Cl
|
|
896
|
Cn1c(cnc1c2cc(=O)c3ccccc3o2)Cl
|
|
897
|
C1CCC2C(C1)C-3CSCCC3N2
|
|
898
|
c1cc(sc1/C=C/2C(=NC(=O)N2)[O-])Br
|
|
899
|
Cc1cc([nH]c(=O)c1C2=NCCN=C(C2)C(F)(F)F)C
|
|
900
|
Cc1[nH]cc(n1)c2ccccc2
|
|
901
|
CN(C)C(=O)Sc1cccnc1
|
|
902
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
903
|
|
|
904
|
CC1=C(C[S@@](=O)N(C1)C(=O)c2ccccc2)C
|
|
905
|
c1ccc2c(c1)CCN2CC(=O)N3[C@H]4CC[C@@H]3c5c(nns5)C4
|
|
906
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
907
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
908
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
909
|
C1CCC2C(C1)[C@@H]3C[C@]2(C=C3)CO
|
|
910
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
911
|
COC(=O)/C=c/c(=O)n2c(s1)ncn2
|
|
912
|
CCOC(=O)c1c2n(cn1)-c3ccc(cc3C(=O)N(C2)C)F
|
|
913
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
914
|
C1CCC(C(C1)NC2[NH+]C(C(N2O)[O-])N)F
|
|
915
|
c1c[nH]nc1Nc2c(nc(c(n2)Cl)Cl)Cl
|
|
916
|
CC1=NN=C2[C@H]1C(=c3ccccc3=[NH+]2)Oc4ccc(cc4)OC
|
|
917
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
918
|
c1c(cnc2c1non2)Br
|
|
919
|
Cc1cc2c(nc1Cl)OCCC2
|
|
920
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
921
|
Cc1ccc(cc1)c2nc(c(nn2)C)Sc3ccc(cc3)F
|
|
922
|
C1CC2C3=C4[C@@H](C=C3C1)NC(=O)[C@]45CCCC[C@@H]5C2
|
|
923
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
924
|
[H]/N=c/[nH]c-2c(s1)-c3cccc4c3c2ccc4
|
|
925
|
|
|
926
|
CC1(Cc2c3c(nc(nc3sc2C(=O)C1)C(F)(F)F)[O-])C
|
|
927
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
928
|
c1ccc(cc1)n2c(=O)c-3c4n(nnc3n2)CCC4
|
|
929
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
930
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
931
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)[nH]n2
|
|
932
|
CCO/C(=C/C1=NC(=O)[C@@](C1)(C(F)(F)F)[O-])/[O-]
|
|
933
|
C1CCC2C(C1)C3C([NH]2)C(=O)C(CS3)C#N
|
|
934
|
COC(=O)N1C[C@@H]2CC=C[C@@H](C2)C3C1CCCC3
|
|
935
|
C1CCC(CC1)C2NCC3N2NCN3C4CCCCC4
|
|
936
|
[H]/N=c/n(nc(s1)C)Cc2ccccc2
|
|
937
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
938
|
c1ccc(cc1)C2=Nc3ccccc3N[C@H]2C(=O)[O-]
|
|
939
|
Cc1ccc(cc1)C2=Cc3ccccc3NC=C2
|
|
940
|
COC(=O)[C@@H]1c2c(oc3cc(cc(c3c2=O)O)CO)C=C[C@@H]1O
|
|
941
|
Cc1c2cc(sc2nc3c1[nH]c(cc3=O)[O-])c4cccs4
|
|
942
|
c1cc2cccc3c2c(c1)C4=NCCN=C34
|
|
943
|
Cc1c(nccn1)c2ccnn2S(=O)(=O)c3ccccc3
|
|
944
|
Cc1c2c(nc(oc2=O)c3ccccc3Cl)on1
|
|
945
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
946
|
CCCCOC1=N[C@@H]2[C@@H](CNC2=O)CO1
|
|
947
|
c12c(non1)N=C3C(=Nc4c(non4)N3)N2
|
|
948
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
949
|
c1ccc(cc1)NC(=O)c2ccccn2
|
|
950
|
c1cc2cc(n3c2c(c1)SCC3)C(=O)[O-]
|
|
951
|
CC(=O)Nn1c2ccccc2nn1
|
|
952
|
Cc1cnc(c(c1OC)C)C[C@@H]2Nc3ccccc3S2
|
|
953
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
954
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
955
|
CSc1nnc2n1[nH]cn2
|
|
956
|
c1ccc(cc1)C(=O)C2=Nc3ccccc3/C(=Cc4ccccn4)/N2
|
|
957
|
[H]/N=C/NC(=C2[C@@H]([C@@H](C(=O)N=C2N1)C#N)c3ccccc3)[O-]
|
|
958
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
959
|
c1ccc(cc1)n2c(c-3sc4ccccc4nc3c2=O)[O-]
|
|
960
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
961
|
|
|
962
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
963
|
CN(C)c1c(c(c(c([o+]1)N)C#N)c2ccc(cc2)OC)C#N
|
|
964
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
965
|
c1cn[nH]c1[C@@H]2CCCN(C2)S(=O)(=O)N3CCCCCC3
|
|
966
|
C/N=c/1scc(s1)C23CC4CC(C2)CC(C4)C3
|
|
967
|
C=CCN1[C@@H]2C=CC=C[C@@H]2C(=O)C1=O
|
|
968
|
CC1=CC(=O)N2CC3CC(CCC3N=C2N1)CL
|
|
969
|
C[C@@H]1C=CC[C@@]2(N1C(=O)C3CCCCC3C2=O)C#N
|
|
970
|
Cc1c(sc2n1ncn2)c3csc(n3)C
|
|
971
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
972
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
973
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
974
|
CCN([C@H]1CC(=NC1=O)[O-])C(=O)c2ccc(cc2)F
|
|
975
|
c1c2n(nn1)CCn3c(cnn3)S2
|
|
976
|
Cc1c(noc1N2CCOC2=O)C
|
|
977
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
978
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
979
|
C1CCC2C(C1)CCC3C2CN=C4N3C(=O)CC4
|
|
980
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
981
|
C1CNC([NH]1)[C@@H]2CCCCN2C(=O)C3CC3
|
|
982
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
983
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
984
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
985
|
COc1cc(c(s1)C(=O)OC)OC(=O)c2ccco2
|
|
986
|
c1ccc2c(c1)C(=O)c3cccc4c3C2=NNS4(=O)=O
|
|
987
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
988
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
989
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
990
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
991
|
c1ccc(cc1)c2ncc(o2)c3ncco3
|
|
992
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
993
|
C[C@H]1CO[C@]2(C(=C(C=C(O2)O)OC)C1=O)C
|
|
994
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
995
|
c1ccc2c(c1)CCC3=C2CCC(=O)N3
|
|
996
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
997
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
998
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
999
|
COC(=O)N1c2ccccc2N(C1C#N)C(=O)OC
|
|
1000
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
Mouse click action: | Basic controls: | |||||||
---|---|---|---|---|---|---|---|---|
Left-Click to rotate Shift-Left-Click up & down to zoom Right-Click for Jmol's context menu | ||||||||
Jmol: an open-source Java viewer for chemical structures in 3D.http://www.jmol.org/ | ||||||||