(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
2
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
3
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
4
|
C[C@@H](c1ccncn1)N(C)Cc2ccc(o2)Sc3ncccn3
|
|
5
|
c1csc(n1)/N=C(/CN2CCOCC2)[O-]
|
|
6
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
7
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
8
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
9
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
10
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
11
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
12
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
13
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
14
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
15
|
CC(=O)NC1=N[C@@]2([C@@H](c3ccccc3[C@@]2(N1)O)O)O
|
|
16
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
17
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
18
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
19
|
Cc1ccc(nc1)C[S@@](=O)C2=NC3=CS[C@H](C3=N2)C(=O)C
|
|
20
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
21
|
CCCCn1c(nnn1)NC(=O)N(C)Cc2nc(no2)CC
|
|
22
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
23
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
24
|
CC(=CC[C@@]1(c2c(c(c3ccoc3n2)OC)CC[C@@H]1O)OC)C
|
|
25
|
Cc1ccccc1OCC(=O)Nn2c(nnn2)Nc3ccccc3
|
|
26
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
27
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
28
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
29
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
30
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
31
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
32
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
33
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
34
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
35
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
36
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
37
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
38
|
Cc1cc(nc(n1)Sc2nc(nc(n2)Cl)NC)C
|
|
39
|
C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NCCCc4[n-]nnn4)C
|
|
40
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
41
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
42
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
43
|
Cc1nnc(s1)Sc2cc(nc(n2)N)Cl
|
|
44
|
|
|
45
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
46
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
47
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
48
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
49
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
50
|
c1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)[O-]
|
|
51
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
52
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
53
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
54
|
CNC(=O)NCNC(=O)NC
|
|
55
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
56
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
57
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
58
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
59
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
60
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
61
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
62
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
63
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
64
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
65
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
66
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
67
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
68
|
CC1C(CC(NN1)C2CCCCC2)N(C)C3CCCCC3
|
|
69
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
70
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
71
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
72
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3ccc4c(c3)OCO4
|
|
73
|
|
|
74
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
75
|
Cc1nc2c(nc(=O)n(c2s1)CC(=O)N)c3cccs3
|
|
76
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
77
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
78
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
79
|
c1cc(ccc1N2CCC(=C2[O-])C(=O)/N=c/3[nH]ccs3)F
|
|
80
|
Cn1cc(c(n1)c2ccncc2)c3ccc4c(c3)C(=O)NC4
|
|
81
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
82
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
83
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
84
|
c1cc(cnc1)c2cc3c(ncnc3o2)NC(=O)C4CC4
|
|
85
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
86
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
87
|
Cc1c2c(c(oc2ncn1)c3ccco3)c4ccco4
|
|
88
|
Cc1ccc(c(c1)n2c3c(nn2)[C@@](CS3)(c4ccccc4)O)C
|
|
89
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
90
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
91
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
92
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
93
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
94
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
95
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
96
|
Cn1c(c(nnc1=O)c2ccsc2)c3ccsc3
|
|
97
|
Cc1nc2cc([nH]c2c(n1)N3CCC=CC3)c4ccccc4
|
|
98
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
99
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
100
|
c1cnn(c1)Cn2cc(cn2)N
|
|
101
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
102
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
103
|
Cc1ccc(cc1)/N=c/2c3c[nH]nc3[nH]cn2
|
|
104
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
105
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
106
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
107
|
c1ccc(cc1)n2cc(cn2)CSc3nncs3
|
|
108
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
109
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
110
|
c1c[nH]nc1C(=O)Nc2nccs2
|
|
111
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
112
|
c1ccc(cc1)C2=CC(=Nn3c(nnn3)N2)c4ccccc4
|
|
113
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
114
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
115
|
Cc1c(oc(c1C#N)NC(=O)CN2CCOCC2)C
|
|
116
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
117
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
118
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
119
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
120
|
c1ncn(n1)NCNn2cncn2
|
|
121
|
CNC1C(=O)NC(SN1)SC2NC(=O)C(NS2)NC
|
|
122
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
123
|
c1ccnc(c1)NC(=O)Nc2cccc3c2-c4cccn4C3=O
|
|
124
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
125
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
126
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
127
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
128
|
c1cc(cnc1)c2cc(c3c(n2)nc(nc3[O-])N)C(F)(F)F
|
|
129
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
130
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3cc4c(s3)CCC4
|
|
131
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
132
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
133
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
134
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
135
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
136
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
137
|
C1CCC2C(C1)[C@@](C(=O)N2)(NC3C(NC(C(N3)C#N)C#N)N)O
|
|
138
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
139
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
140
|
CC(=O)NC1NCNC(N1)N
|
|
141
|
Cc1c(cco1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
142
|
Cc1c2c(nc(n1)n3cc(nn3)c4ccccc4)CCCC2
|
|
143
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
144
|
c1ccc2c(c1)[nH]c(=O)n2c3nc4c(o3)cccn4
|
|
145
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
146
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2c(=O)c3ccccc3nn2
|
|
147
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
148
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
149
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
150
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
151
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
152
|
Cc1nnc(s1)SCSc2ccccn2
|
|
153
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
154
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
155
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
156
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
157
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
158
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
159
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
160
|
CCNc1nc2c(s1)c(c(c(n2)N)C#N)c3ccccc3
|
|
161
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
162
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
163
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
164
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
165
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
166
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
167
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
168
|
CC(C)(C)c1csc(n1)c2ccc(nc2)n3cncn3
|
|
169
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
170
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
171
|
c1ccc(cc1)S(=O)(=O)C[C@@H]2CSc3n2ncn3
|
|
172
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
173
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC=C)CCn2cccn2
|
|
174
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
175
|
C[C@@H]1c2nc(nn2[C@](C(=O)O1)(C)CC#C)[C@@H](C)O
|
|
176
|
Cc1c2ccccc2c(nn1)Sc3nccn3C
|
|
177
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
178
|
COc1cc(=O)nc(o1)c2ccco2
|
|
179
|
|
|
180
|
c1ccc2c(c1)ncc(n2)c3cnc(nc3c4ccncc4)N
|
|
181
|
Cc1cc(nc(n1)Sc2ccc(nn2)Cl)C
|
|
182
|
CSc1c(c(sn1)SC)NC(=O)OC[C@@H]2CCCO2
|
|
183
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
184
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
185
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
186
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
187
|
c1ccc2c(c1)c(ncn2)N3CCNc4c3cccc4
|
|
188
|
|
|
189
|
Cc1c2ccccc2nc(c1C(=O)[O-])Cn3cccn3
|
|
190
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
191
|
CCOc1nnc(s1)Cn2nc(nn2)c3ccccc3
|
|
192
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
193
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
194
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
195
|
c1ccc(cc1)/C=C/c2ccncn2
|
|
196
|
Cc1cc(=O)n2n1c3ccccc3nn2
|
|
197
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
198
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
199
|
CC(=O)N1CCC(CC1)c2nc3c(c(n2)[O-])nccn3
|
|
200
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
201
|
COCCn1c(=O)ccc(n1)C(=O)n2c3ccccc3c(n2)N
|
|
202
|
Cn1c(nnc1Sc2cnccn2)c3ccc(cc3)F
|
|
203
|
CCSc1nnc(n1C)CSc2c([nH]c3c2cccc3)C
|
|
204
|
Cc1ccc(cc1)SCCN(C)Cc2cnc(nc2)OC
|
|
205
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
206
|
CC(C)(C)OC(=O)N1CCCCc2c1nccc2
|
|
207
|
Cc1c2c(c(=O)n(nn2)CC(=O)NC)n(n1)C
|
|
208
|
CC1C2C(NNC1NC(=O)C)C[C@@H](C2)C(=C)C
|
|
209
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
210
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
211
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
212
|
c1ccc(cc1)c2cc(on2)[C@@]3(CC[C@H]4CO[C@@H]3O4)O
|
|
213
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
214
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
215
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
216
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
217
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
218
|
|
|
219
|
CC1CC2CC3CCCNN3C2NN1
|
|
220
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
221
|
c1c(c(n2c(n1)ncn2)[O-])n3cncn3
|
|
222
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
223
|
CC(C)N1C(NNN1)SC2CNN(C(=O)C2CL)C
|
|
224
|
CC1CSC(=O)N1CCN2C(=O)C3CCCCC3NN2
|
|
225
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
226
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
227
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
228
|
CC1(c2ccccc2NC(=O)c3c1cc(nn3)C(=O)OC)C
|
|
229
|
Cc1c(nnn1c2nccs2)C(=O)[O-]
|
|
230
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
231
|
CC1=C(C[S@@](=O)N(C1)c2nc(sn2)SC)C
|
|
232
|
CN(C)c1nnnn1c2ncccn2
|
|
233
|
CCOc1nnc(s1)CN2CCOCC2
|
|
234
|
c1ccc(c(c1)N)Nc2c(cn(c(=O)n2)Cc3cccs3)C#N
|
|
235
|
c1cc(nnc1n2cncn2)[O-]
|
|
236
|
c1ccc2c(c1)ccn2Cc3nnc(s3)Cc4cccs4
|
|
237
|
c1c(=O)[nH]c(nc1[O-])Nn2cnnc2
|
|
238
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
239
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
240
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
241
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
242
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
243
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
244
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
245
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
246
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
247
|
CS(=O)(=O)Nc1ncccn1
|
|
248
|
c1c(nc2n1CCS2)CNC(=O)[C@@H]3CC(=O)OC34CCCC4
|
|
249
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
250
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
251
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
252
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
253
|
Cc1ccc(cc1)c2nc(c(nn2)C)Sc3ccc(cc3)F
|
|
254
|
CN1C(NCN1)CCC2CCCCC2
|
|
255
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
256
|
CCN(CC)C1C(NNC2N1NC3C2CCCN3)C
|
|
257
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
258
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
259
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
260
|
c1ccnc(c1)c2nnc(s2)c3ccc(cc3O)O
|
|
261
|
c1ccc2c(c1)nn(n2)[C@@H](c3ccco3)C(=O)c4cccs4
|
|
262
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
263
|
c1ccc2c(c1)nnn2CC#C[C@@H](c3ccco3)O
|
|
264
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
265
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
266
|
Cc1cc(no1)CS(=O)(=O)NC
|
|
267
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
268
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
269
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
270
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
271
|
|
|
272
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
273
|
C[C@@H]1CC=CCN(C1)S(=O)(=O)c2ccccn2
|
|
274
|
Cc1c2ccccc2[nH]c(=O)c1Sc3nnnn3C
|
|
275
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
276
|
c1ccc2c(c1)-c3c(nc4nnnn4n3)C2=O
|
|
277
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
278
|
C[C@H]1C=C[C@H]2CCCC[C@H]2[C@@H]1C3CC(C(C(=O)O3)CO)OC
|
|
279
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
280
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
281
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
282
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
283
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
284
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
285
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
286
|
CCSC1C2C(CN[NH]2)NCN1
|
|
287
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
288
|
|
|
289
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
290
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
291
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
292
|
Cc1nccc(n1)Sc2ccccc2
|
|
293
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
294
|
CN1CCc2c(c(nc3c2c(n[nH]3)N)Nc4ccc(cc4)OC)C1
|
|
295
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
296
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
297
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
298
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
299
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
300
|
CC1=CC(=O)Nc2cncnc2N1
|
|
301
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
302
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
303
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
304
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
305
|
Cc1nc2c(s1)c(nnc2[O-])c3ccco3
|
|
306
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
307
|
c1ccc2c(c1)[nH]c(n2)[C@H](C#N)c3c(nc(c(n3)C#N)C#N)Cl
|
|
308
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
309
|
c1ccc(cc1)NC(=O)N(c2ccccc2)C3=NCCC3
|
|
310
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
311
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
312
|
c1ccc(cc1)C2=C(C=NC(=C3C=CC(=O)C=C3)N2)c4cnccn4
|
|
313
|
Cc1[nH]n2c(n1)c(c3c2nc4ccccc4n3)C(=O)NCCOC
|
|
314
|
c1ccc(c(c1)C(=O)[O-])Sc2c(nccn2)Cl
|
|
315
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
316
|
Cc1c(c(nc(n1)C)SCc2nnc(s2)SC)C(=O)C
|
|
317
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
318
|
Cc1c(non1)OCCNC(=O)C23CC4CC(C2)CC(C4)C3
|
|
319
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
320
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
321
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
322
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
323
|
c1ccnc(c1)SCc2c(snn2)Cl
|
|
324
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
325
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
326
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
327
|
C[C@@H](c1cccc(c1)F)Oc2cccc3n2c(nn3)c4c[nH]cn4
|
|
328
|
|
|
329
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
330
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
331
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
332
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
333
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
334
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
335
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
336
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
337
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
338
|
CC1C2C(NC(NN2)N3CCOCC3)N(N1)C4CCCCC4
|
|
339
|
c1ccc(cc1)c2ccncn2
|
|
340
|
C1CCC(CC1)S(=O)(=O)OC2CCC(NN2)[O-]
|
|
341
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
342
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
343
|
|
|
344
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
345
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
346
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
347
|
|
|
348
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
349
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
350
|
CCc1nnc(s1)/N=C(/[C@@H](C2CCCC2)NC(=O)C)[O-]
|
|
351
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
352
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
353
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
354
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
355
|
CC(=O)N1CCC(CC1)c2nnc(s2)c3ccco3
|
|
356
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
357
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
358
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
359
|
CC1C(NN2C(NC(C2N1)C(=O)N)C)C
|
|
360
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
361
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
362
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
363
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
364
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
365
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
366
|
c1cc(sc1)c2nn(c(=O)n2c3ccncc3)CCC#N
|
|
367
|
Cc1cc-2n(n1)[C@@H](Nc3c2cccc3)c4cccnc4
|
|
368
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
369
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
370
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Nc3ccc4c(c3)OCO4
|
|
371
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
372
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
373
|
CCOC(=O)Cc1[nH]ncn1
|
|
374
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
375
|
c1ccc2c(c1)CCN2CC(=O)N3[C@H]4CC[C@@H]3c5c(nns5)C4
|
|
376
|
|
|
377
|
C1CCC2C(C1)C(N3C2SCC3)C4NC(NC(N4)F)F
|
|
378
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
379
|
Cc1cnc(nc1c2ncnn2C)N
|
|
380
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
381
|
|
|
382
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
383
|
c1cnc(c(n1)C#N)NCc2nc3c(s2)CCCC3
|
|
384
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
385
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
386
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
387
|
Cn1c(nnn1)SCc2cnc(s2)c3ccccc3
|
|
388
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
389
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
390
|
c1cnn(c1)Cc2nnc3n2CCC3
|
|
391
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
392
|
CCSc1ncnc(n1)N
|
|
393
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
394
|
Cc1ccc(c2c1cc3c(n2)OCC(=O)N(C3)C4CC4)C
|
|
395
|
CCOC(=O)N1CN(Cc2c1oc3ccccc3c2=O)CCO
|
|
396
|
Cc1cc2nc(nc(=O)n2o1)Oc3ccccc3
|
|
397
|
CC(=O)NCC1CNCCN1
|
|
398
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
399
|
Cn1c2ccccc2n(c(=O)c1=O)Cc3ccon3
|
|
400
|
COc1cc(nc(n1)Oc2ccccc2c3ccno3)OC
|
|
401
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
402
|
CN(C)C(=O)N[C@@H](C(Cl)(Cl)Cl)Nc1[nH]ncn1
|
|
403
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
404
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
405
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
406
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
407
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
408
|
COc1ccc(cc1)n2c3ccccc3nc2Cn4cnc(n4)C#N
|
|
409
|
CCc1ccc(cc1)[C@@H]2c3cc(ccc3-c4c2nc(o4)N)N
|
|
410
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
411
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
412
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
413
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
414
|
|
|
415
|
CC1NCC(N1CC2CCCCC2)[C@@H](C3CCCO3)O
|
|
416
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
417
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
418
|
c1ccc(cc1)c2nc(cc(=O)o2)[O-]
|
|
419
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
420
|
c1ccc(cc1)NC(=O)[C@@H]2Cc3c2cccc3
|
|
421
|
C=Cc1c(c(c2n1cccc2)c3c4ccccc4c(=O)[nH]n3)N
|
|
422
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
423
|
Cc1[nH]c(=O)c(c(n1)Sc2cccn2C)C(F)(F)F
|
|
424
|
c1ccc(c(c1)NC(=O)[C@@H]2CC(=O)N=C3[C@@H]2C(=O)CCC3)F
|
|
425
|
c1ccc2c(c1)[nH]c(n2)c3ccco3
|
|
426
|
CC(C)(C)CN1C[C@@H](CC1=O)NC(=O)CCc2cnccn2
|
|
427
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
428
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
429
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
430
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
431
|
Cc1csc(n1)Sc2nnc(n2C)c3ccccc3
|
|
432
|
c1cnc(nc1)N2CCC[C@H]2c3nc(no3)c4cncnc4N
|
|
433
|
CC(=O)N1CCC(=C2c3ccccc3CCc4c2nccc4)CC1
|
|
434
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
435
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
436
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
437
|
Cc1c(nnn1c2ccccc2)S(=O)(=O)c3ccccc3
|
|
438
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
439
|
CCCCCCC1CN[NH]N1
|
|
440
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
441
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
442
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
443
|
c1ccc(cc1)c2cn(nn2)CC(=O)[O-]
|
|
444
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
445
|
c1ccc(cc1)N2CCN(CC2)Cc3nnnn3Cc4ccco4
|
|
446
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
447
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
448
|
Cc1nnc(o1)CSc2ccccn2
|
|
449
|
COC(=O)c1c(sc(n1)N2CCCCC2)C(=O)c3ccco3
|
|
450
|
CC1=NC2=NC(=NC(=O)C2=C1Sc3ccccn3)[NH-]
|
|
451
|
CC(=O)Nc1nnc(s1)c2c(non2)N
|
|
452
|
Cn1c2c(cn1)nc3c(c2Cl)CCCC3
|
|
453
|
CC(=O)C1C2C(NC(N1)C(=O)C)N(CN2)C(=O)C
|
|
454
|
Cc1cc2ccccc2n1Cc3nnc(s3)c4ccccc4
|
|
455
|
|
|
456
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
457
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
458
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
459
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
460
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
461
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
462
|
c1ccc(cc1)c2nn(c(=O)o2)CN3CCOCC3
|
|
463
|
c1ccc(cc1)/C=C/CN2CCC(CC2)C#N
|
|
464
|
Cc1c(c(on1)C)c2nc(no2)CN3CCOCC3
|
|
465
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
466
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
467
|
c1c([nH]nn1)SCC(=O)N
|
|
468
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
469
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
470
|
CC1CC([NH]/C(=NC(=O)CC2C(CCCC2CL)F)/C1)C
|
|
471
|
CCOC(=O)Nc1c(n[nH]n1)Cl
|
|
472
|
Cc1c(sc(n1)Cc2nc(cs2)O)C
|
|
473
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
474
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
475
|
Cn1c(=O)[nH]c(=O)n2c1ncc2CC(=O)Nc3ccccc3
|
|
476
|
c1c(nc(cn1)Cl)n2cncn2
|
|
477
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
478
|
c1ccc2c(c1)c(=O)c(=Nc3[n-]nnn3)c2=O
|
|
479
|
CCc1c(nc(oc1=O)/C=C/c2ccccc2)[O-]
|
|
480
|
c1cc2c3ccnn3nnc2cc1Cl
|
|
481
|
CC1C(SC(N1)C[C@@H](C)N2CC(CN2)CL)C(=O)C
|
|
482
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
483
|
|
|
484
|
C[C@@H]1CCCC[C@@H]1NC(=O)COc2cnc(nc2)c3ccccc3
|
|
485
|
Cc1c(c(n(n1)C)Sc2ccccn2)N
|
|
486
|
C1CCc2c(c3c(c([nH]c3s2)C#N)N)C1
|
|
487
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
488
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
489
|
Cc1ccc(=O)n(c1)C(=O)c2cc(cc(n2)c3ccccc3)OC
|
|
490
|
Cc1nc(nc(=O)n1c2ccccc2)Nc3ccccc3
|
|
491
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
492
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
493
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
494
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
495
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
496
|
[H]/N=c/n2c(c(cnc2nn1c3ccccc3)O)C
|
|
497
|
CC(=CC[C@@H]1[C@@H](CCC1=O)c2cc(on2)Cc3ccccc3)C
|
|
498
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
499
|
c1cn(nc1n2cnnn2)C34CC5CC(C3)CC(C5)C4
|
|
500
|
Cn1c2c([nH]c1=O)nncn2
|
|
501
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
502
|
c1cnc(nc1c2nccs2)N
|
|
503
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
504
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
505
|
CCC(=O)c1cc(c(c(c1)Sc2cccc3c2nccc3)O)C
|
|
506
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
507
|
c1ccc2c(c1)C(=NS2(=O)=O)Nc3ccccn3
|
|
508
|
|
|
509
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
510
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
511
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
512
|
c1cc(cc(c1)N/C=c/2ccc3c4c2cccc4c(=O)n3)C(=O)[O-]
|
|
513
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
514
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
515
|
|
|
516
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
517
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
518
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
519
|
Cc1cc(no1)CSc2ccccn2
|
|
520
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
521
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
522
|
C[C@@H](Nc1nccs1)n2cncn2
|
|
523
|
COc1cccc(c1)C2=CCN(C(=O)N2)c3ccccc3O
|
|
524
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
525
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
526
|
Cc1cc(n(n1)CNc2nccs2)C
|
|
527
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
528
|
C1CC(OC1)C2CNC3C(N2)C(NC(N3)N)N
|
|
529
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
530
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
531
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
532
|
c1ccc(cc1)c2nnc(o2)Sc3nc4ccccc4s3
|
|
533
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
534
|
CN1CCOc2c1cnn(c2=O)CCO
|
|
535
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
536
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
537
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
538
|
c1ccc(cc1)n2c3c(c(ncn3)[O-])nn2
|
|
539
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
540
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
541
|
CSc1nc(cc(n1)n2cnc3c2cccc3)c4ccccc4
|
|
542
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
543
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
544
|
c1ccc(cc1)NC(=O)c2ccccn2
|
|
545
|
CC1=C(Oc2ccccc2O1)c3ccccn3
|
|
546
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
547
|
c1cc(ncc1C#N)NCc2nccs2
|
|
548
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
549
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
550
|
CCN(CC)C1=NS(=O)(=O)C2CCCCC2C(=O)[C@@H]1C
|
|
551
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
552
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
553
|
|
|
554
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
555
|
CC1=C[C@@H]2Cc3c(c(c4c(n3)oc(n4)C5CC5)N)[C@@H](C2)C1
|
|
556
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
557
|
CNc1c(ncnn1)C(=O)[O-]
|
|
558
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
559
|
C1CCC(CC1)COC(=O)N2C[C@@H]3CC[C@H]2CC(=O)O3
|
|
560
|
C[C@@H](Cc1ccccc1)N(CC#C)C(=O)OC2=CCN(CC2)C
|
|
561
|
COC(=O)c1c2c(nnc(n2nc1C(=O)OC)[O-])c3ccccc3
|
|
562
|
|
|
563
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
564
|
c1c2c(n3c(n1)ncn3)CCC2
|
|
565
|
Cc1c(oc2c1cc(c(c2)OC)/C(=C/C(=N/c3[nH]ncn3)/[O-])/C)C
|
|
566
|
c1ccc2c(c1)[C@@H](CC(=O)N2)C(=O)N3CCn4c(ncn4)C3
|
|
567
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
568
|
Cc1cc(nc(n1)n2c3c(cn2)C(=O)CCC3)C
|
|
569
|
CC1([C@@H](N(C(=O)N1C)c2cccc3c2cccc3)n4cncn4)C
|
|
570
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
571
|
Cc1cc(sn1)[C@@H](c2ccc(cc2)C(C)C)Nc3cccnc3
|
|
572
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
573
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
574
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
575
|
C1CCC(CC1)C2=CC(=C[C@@](O2)(C3CCCCC3)O)C4CCCCC4
|
|
576
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
577
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
578
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
579
|
Cc1nc(on1)Cn2c(=O)n(c(=O)n(c2=O)CC=C)CC=C
|
|
580
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
581
|
COCCn1c(nnn1)[C@@H](c2ccncc2)N3CCCC3
|
|
582
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
583
|
c1ccc(cc1)c2c([nH]nc2c3[nH]c4ccccc4n3)c5ccco5
|
|
584
|
c1cnn(c1)c2ccc(cc2c3nnc4n3ccnc4)F
|
|
585
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
586
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
587
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
588
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
589
|
Cc1csc(=O)n1CCC(=O)[C@@H](C#N)c2ccccn2
|
|
590
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
591
|
C[C@@]1([C@@H](c2cc(ccc2OC1(C)C)C#N)Oc3ccccn3)O
|
|
592
|
c1ccc(cc1)S(=O)(=O)Nc2cc3cnnn3c(n2)N
|
|
593
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
594
|
c1ccc(cc1)c2c3ccccc3[nH]c(=O)c2n4cnc(n4)C#N
|
|
595
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
596
|
|
|
597
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
598
|
COc1ccccc1/N=c/2cccccc2O
|
|
599
|
c1cc(cc2c1cc3c([o+]2)/C=Cc4ccc(cc4OC3=O)O)O
|
|
600
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
601
|
Cc1ccc(cc1)OCn2cc(cn2)N
|
|
602
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
603
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
604
|
C=CCNc1cn[nH]c(=O)n1
|
|
605
|
C1CCc2nn3c(n2CC1)c(c(nc3=O)SCC(=O)N)C#N
|
|
606
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
607
|
CN1[C@@H]([C@H](CC1=O)c2ccccc2)[C@H](C#Cc3ccccn3)O
|
|
608
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
609
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
610
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
611
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
612
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
613
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
614
|
Cc1cc(nc(n1)n2c(c(c(=O)c(n2)C)c3ccccc3)N)C
|
|
615
|
Cn1c(c(c(=O)[nH]c1=O)Sc2nc3ccccc3s2)N
|
|
616
|
c1cnccc1CSc2nncs2
|
|
617
|
c1ccc(cc1)n2cc3cnnc(c3n2)[O-]
|
|
618
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
619
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
620
|
CCn1/c(=N/C(=O)C)/sc(n1)SCc2ccccc2
|
|
621
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
622
|
C1COCCN1CCCN2C[C@@]34C[C@@H](O3)CC(=C4C2=O)C(=O)[O-]
|
|
623
|
CC1NC(ON1)C2CNCCN2
|
|
624
|
CC(C)C(=O)N[C@@H](C(Cl)(Cl)Cl)n1cncn1
|
|
625
|
Cc1cc(nc(n1)n2c(=O)ccc(n2)[O-])C
|
|
626
|
Cc1cc(c(=O)n(c1)Cc2cccc(c2)F)NS(=O)(=O)C
|
|
627
|
Cc1ccc(cc1)[C@@H](C/C=C
2c(cc(n2)C)C)O
|
|
628
|
Cn1c-2n/c(=NCc3ccccc3)/n(c2c([nH]c1=O)[O-])CC(=O)[O-]
|
|
629
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
630
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
631
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
632
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
633
|
Cc1cnc(o1)Cn2cccn2
|
|
634
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
635
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
636
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
637
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
638
|
CCNC(=O)n1cc(c(n1)c2ccccc2)c3ccncn3
|
|
639
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
640
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
641
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
642
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
643
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
644
|
c1ccc(cc1)CN2CCc3c(c4cccc5c4n3CC(=O)N5)C2
|
|
645
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
646
|
CC1(OC[C@H]([C@H](O1)c2cccnc2)C/C=CCCC(=O)[O-])C
|
|
647
|
|
|
648
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
649
|
c1cnc(nc1)N2CCc3c(ccs3)C2
|
|
650
|
Cc1c(sc(n1)c2c(cnc(n2)NCC=C)c3ccsc3)C
|
|
651
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
652
|
Cc1cc2n(n1)[C@@H](CC(=N2)O)C(=O)Nc3ccccc3F
|
|
653
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC(=O)c2ccccc2)CC=C
|
|
654
|
CCSc1nnc(s1)N/C(=C/Sc2ncccn2)/[O-]
|
|
655
|
c1ccc2c(c1)CN(c3cccnc3O2)c4ccc(s4)C(=O)[O-]
|
|
656
|
C[C@@]1(COC(=N1)COc2ccccc2)CO
|
|
657
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
658
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
659
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
660
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
661
|
CCOC1NNC(S1)CSC2CCCCN2
|
|
662
|
c1ccc(cc1)c2nnc(o2)Cn3c4ccccc4sc3=O
|
|
663
|
Cc1cc(nc(n1)Nc2ncc(n2c3ccccc3)O)C
|
|
664
|
Cc1ccc(cc1)n2cnc(=O)c(n2)C#N
|
|
665
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
666
|
CC1C(=O)C(C2CCCCN2N1)C3CCCCC3
|
|
667
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
668
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
669
|
Cn1c(=O)c(c(cn1)SCc2ccco2)Cl
|
|
670
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
671
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
672
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
673
|
CC(=O)NCCn1cccn1
|
|
674
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
675
|
c1ccc(cc1)[C@H]2[C@H](C(=O)N2)O
|
|
676
|
CS(=O)(=O)NCc1ccccn1
|
|
677
|
c1cc2c(cc1CN3[C@@H]4C=CC=C[C@H]4C(=O)C3=O)OCO2
|
|
678
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
679
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
680
|
c1ccc-2c(c1)CN[C@@H](c3n2ccc3)c4ccc(cc4)F
|
|
681
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
682
|
COC(=O)c1c2c(n3cnnc3n1)OCC2
|
|
683
|
c1cc2c(cc1C(F)(F)F)Nc3c(nnc(n3)[O-])S2
|
|
684
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
685
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
686
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
687
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
688
|
c1ccc(cc1)/C=C/Cn2c(=O)c3c(cccn3)oc2=O
|
|
689
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
690
|
Cc1cc(nc(n1)N=C2NCCN2)C
|
|
691
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
692
|
Cc1c(sc2c1c(nnc2c3ccccc3)N4CCCC4)C#N
|
|
693
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
694
|
C/C(=C/1CCOC1=O)/Nc2[n-]nc(n2)C(F)(F)F
|
|
695
|
c1cc(sc1)c2ccncn2
|
|
696
|
CC1(C[C@@H](c2n1ccc2)Nc3ccc(cc3)OC)C
|
|
697
|
|
|
698
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
699
|
|
|
700
|
|
|
701
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
702
|
C[C@@H](c1ccccc1)Nc2cc3c(cn2)onc3c4ccccc4
|
|
703
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
704
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
705
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
706
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
707
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
708
|
CCNc1nc(nc(n1)Cl)Sc2nnc(s2)SC
|
|
709
|
CC(=O)Nc1nnc(s1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
710
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
711
|
Cc1c(c2c(s1)c(=O)[nH]nn2)C(=O)[O-]
|
|
712
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
713
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
714
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
715
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
716
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
717
|
c1ccc(cc1)c2c(scn2)Cn3cnc4cnccc4c3=O
|
|
718
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
719
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
720
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
721
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
722
|
CN(C)c1nc(nc(n1)OC)n2cc(nn2)c3ccccc3
|
|
723
|
Cn1c2c(cn1)nc([nH]2)c3ccccc3
|
|
724
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
725
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
726
|
C[C@@H]1[C@@H]2[C@@H](C=C3CCCC[C@H]3[C@@H]2/C=C/c4ccccn4)C(=O)O1
|
|
727
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
728
|
c1ccnc(c1)SCc2ccco2
|
|
729
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
730
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
731
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
732
|
C/C=C/[C@@H]1[C@@H]([C@@H](C2=C(O1)[C@@](OC2=O)(C)O)O)O
|
|
733
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
734
|
c1cc(c(cc1c2cn(nn2)C3CCCCC3)Cl)Cl
|
|
735
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
736
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
737
|
C1CCC(CC1)C(=O)N[C@@H]2C(=O)NN=C2[O-]
|
|
738
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
739
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
740
|
COc1ccc(cc1)c2cnnn2Cc3ccco3
|
|
741
|
c1ccc2c(c1)nnn2c3nnns3
|
|
742
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
743
|
Cc1nn2cc(nc2s1)Cn3cnc4c(c3=O)cccc4OC
|
|
744
|
|
|
745
|
Cc1nc2c3c(ncn2n1)OC4=NN=C([C@H]4[C@H]3c5ccccc5)C
|
|
746
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
747
|
CC(C)(C)OC(=O)N1CCc2c(ncnc2Cl)CC1
|
|
748
|
Cc1cc(nc2c1c(on2)N)C
|
|
749
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
750
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
751
|
C1CCC(CC1)C2=N[C@@H]3C4CCCCC4[C@H]2O3
|
|
752
|
CCc1cc2c(cnc(c2o1)OC)C(=O)Nc3c(cncn3)C#N
|
|
753
|
Cc1cc(nc(n1)Nn2c(cc(c(c2=O)C(=O)C)[O-])C)C
|
|
754
|
CCOC(=O)/C=C/1C2NNNN2-C3CCCCC3N1
|
|
755
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
756
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
757
|
CCOc1ccc2c(nc(nc2c1)/N=C/NCCC(=N3)[O-])C
|
|
758
|
Cc1c[nH]/c(=NS(=O)(=O)c2ccccc2)/s1
|
|
759
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
760
|
COc1ccc(cc1)[C@@H]2C(=NC(=O)N2)c3ccc(cc3)OC
|
|
761
|
c1cn(c(n1)CN(Cc2nnnn2C3CC3)C4CC4)C(F)F
|
|
762
|
CCCSc1ncc(cn1)CN[C@@H](CC)c2ncnn2C
|
|
763
|
C1CC(OC1)C2C3C(CNNC3OC2C4CCCO4)N
|
|
764
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
765
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
766
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
767
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
768
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
769
|
Cc1ccc2c(c1)nnc(n2)N
|
|
770
|
|
|
771
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
772
|
Cc1cnc(s1)Nc2cnc(nc2)SC
|
|
773
|
CCn1c(nn(c1=O)C)C(=O)[O-]
|
|
774
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
775
|
Cc1c(nnc(c1c2c(cc(cn2)C(F)(F)F)Cl)O)C
|
|
776
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
777
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
778
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
779
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
780
|
CS(=O)(=O)Nc1ccccn1
|
|
781
|
c1ccc(c(c1)[C@H]2[C@@H](CCC(=O)N2)NCC3=COCCO3)F
|
|
782
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
783
|
C1C2C(NCN1)SC=C(N2)O
|
|
784
|
Cc1nnn(n1)Cc2nnnn2C
|
|
785
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
786
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
787
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
788
|
CN(CC#CCN(C)C1=NC(=O)CC1)C2=NC(=O)CC2
|
|
789
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
790
|
CC1CC(N2C1[C@@H](CC2)O)C3(C(=O)C4CCCCC4C3=O)O
|
|
791
|
CCNc1c(cc(c2c1nccc2)Cc3cnc(nc3N)N)C
|
|
792
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
793
|
Cc1nc2ccccc2c3n1nc(n3)n4cnnn4
|
|
794
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
795
|
Cc1c(cn(n1)C)S(=O)(=O)n2cccn2
|
|
796
|
C1NC2C(S1)C(=O)[NH]C(N2)N
|
|
797
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
798
|
CCCSc1ncc(cn1)CN2CCCn3c(cc(n3)C#N)C2
|
|
799
|
CC(=C)c1nc(nc(n1)Oc2ccccc2)Oc3ccccc3
|
|
800
|
c1ccc(cc1)Nc2c(nnn2c3ccccc3)c4ccn[nH]4
|
|
801
|
Cc1c(cc2c(n1)nc(o2)[O-])c3ccncc3
|
|
802
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
803
|
Cc1nc(no1)Cn2c(=O)n(nn2)c3ccccc3
|
|
804
|
c1ccc(cc1)CS(=O)(=O)n2cnc3c2[nH]c(=O)[nH]c3=O
|
|
805
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
806
|
CCNc2ccccc2S/C1=Cc3nc4ccccc4s3
|
|
807
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
808
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
809
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
810
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
811
|
Cn1c(nnn1)/N=C(/c2ccc(o2)Br)[O-]
|
|
812
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
813
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
814
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
815
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
816
|
CCOC(=C=C(C)c1ccccc1)n2c(ncn2)C
|
|
817
|
c1ccc(cc1)/C=C/c2nnc(o2)N
|
|
818
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
819
|
c1ccnc(c1)CCS(=O)(=O)[O-]
|
|
820
|
c1ccc(cc1)C2=NS(=O)(=O)Nc3c2cccc3
|
|
821
|
CC1C(OC(N1)NC(=O)N(C)C2CC2)C
|
|
822
|
CC1NC(CN1C)S(=O)(=O)[N-]C2CNN(C2)CC(=O)OC
|
|
823
|
c1ccnc(c1)N[C@@H]2C[C@@H]3[C@H](O2)[C@@H](CO3)O
|
|
824
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
825
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
826
|
c1ccnc(c1)c2c(c3n(n2)CCC3)c4ccc(cc4)F
|
|
827
|
CCSc1nnc(o1)c2c(nc3n2ccs3)C
|
|
828
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
829
|
CCCCSc1nc(c2nc3ccccc3c(=O)n2n1)[O-]
|
|
830
|
Cc1c(c(n(n1)Cc2[n-]nnn2)C)Br
|
|
831
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
832
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
833
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
834
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
835
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
836
|
|
|
837
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
838
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
839
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
840
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
841
|
[H]/N=c/n(c2c(s1)nc3ccccc3n2)N
|
|
842
|
c1ccc(cc1)CN2[C@@H]([C@@H]3[C@H](C2=O)OC4(O3)CCCCC4)O
|
|
843
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
844
|
c1ccc(cc1)C2=NC23c4ccccc4-c5c3cccc5
|
|
845
|
CNc1nc(ns1)C23CC4CC(C2)CC(C4)C3
|
|
846
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
847
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
848
|
C1C2CC3CC1CC(C2)(C3)n4nc(c(n4)C(=O)[O-])C(=O)[O-]
|
|
849
|
Cc1ccc(cc1OS(=O)(=O)c2c([nH]c(=O)s2)C)C(C)C
|
|
850
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
851
|
CCOC(=O)c1nc(nc(n1)C(=O)OCC)C(=O)OCC
|
|
852
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
853
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
854
|
c1cc(cc(c1)S(=O)(=O)/N=c/2[nH]c(c3c(n2)nc[nH]3)[O-])C#N
|
|
855
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
856
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
857
|
Cc1csc(n1)Cc2nc(no2)c3ccc(cc3)O
|
|
858
|
Cc1c(nnn1c2ccsc2C(=O)OC)C(=O)C
|
|
859
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
860
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
861
|
CCCCCNS(=O)(=O)c1csc(n1)c2ccc(cc2)F
|
|
862
|
CC(C)C(=O)Nc1nc[nH]n1
|
|
863
|
CCCc1nc2c(o1)cccn2
|
|
864
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
865
|
|
|
866
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
867
|
C1CCC2C(C1)-C3C(CNCN3)S(=O)(=O)CO2
|
|
868
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
869
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
870
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
871
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
872
|
c1ccc(cc1)c2cc(nc3c2c4c(o3)oc(n4)N)c5ccccc5
|
|
873
|
C=CCNc1nc(nc(n1)n2ccnc2)c3ccccc3
|
|
874
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
875
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
876
|
Cc1c2c(nc(n1)N)OCC2
|
|
877
|
|
|
878
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/n2cnc3c2cccc3)[O-]
|
|
879
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
880
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
881
|
Cc1c2ccccc2nc-3c1CSc4c3cccc4F
|
|
882
|
CC(=O)c1n[nH]c2n1ncc2
|
|
883
|
c1cc2c(nc1)S[C@@H]3c4cccnc4S[C@H]2O3
|
|
884
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
885
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
886
|
CC1NC2C(S1)NC(NN2)C3CCCCC3
|
|
887
|
C1CN[C@@](C(=O)N1)(C(F)(F)F)O
|
|
888
|
c1cc2c(cc1C(F)(F)F)nc(s2)c3csnn3
|
|
889
|
C1CCC(CC1)NC2CCC3N(C2=O)CCC3
|
|
890
|
|
|
891
|
c1ccc(cc1)c2nc(on2)SCC(=O)[O-]
|
|
892
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
893
|
CC1(C=C(c2c1ccc(c2)C#N)n3ccccc3=O)C
|
|
894
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
895
|
CCCc1cc(no1)c2cc(=O)n3c([nH]2)c(c(n3)C)CC
|
|
896
|
COc1ccccc1O[C@@H]2C(=O)NC(=NC2=O)c3ncccn3
|
|
897
|
Cn1c(c(c(=O)n1C)c2ccccn2)c3ccc4c(c3)nccn4
|
|
898
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
899
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
900
|
COC(=O)c1cc(nc2c1c(=O)n3cc[nH]c3n2)C4CC4
|
|
901
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
902
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
903
|
c1ccc(cc1)C2=N[C@@](C(=O)N2)(C(F)(F)F)Nc3ccccn3
|
|
904
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
905
|
Cn1c(=O)c2ccccc2c(n1)C(=O)[C@@H](C#N)c3ccccn3
|
|
906
|
CCS(=O)(=O)n1c(cc(n1)c2ccccc2)N
|
|
907
|
CCc1ccc(s1)c2c3c(ncnc3on2)NC
|
|
908
|
CCc1nnc(c2n1ccc2)N3CCC(CC3)C(=O)[O-]
|
|
909
|
C=CCSc1nc2c(c(n1)c3cccs3)CCCC2
|
|
910
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
911
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3c(=O)ccc(n3)c4ccco4
|
|
912
|
COC(=O)NS(=O)(=O)C1CCCO1
|
|
913
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
914
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
915
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
916
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
917
|
C1NC-2C3NN[N-]N3CNC2N1
|
|
918
|
c1ccc2c(c1)CNC(=O)CN2
|
|
919
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
920
|
Cc1ccc(c(c1)n2cccn2)c3c4c(nc[nH]4)ncn3
|
|
921
|
c1ccc(cc1)N(CCC#N)c2c(c3ccccc3s2)Cl
|
|
922
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
923
|
Cc1nc2c(c(n1)N3CCCC3)CN(CC2)C(=O)C
|
|
924
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
925
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
926
|
Cc1cnn(c1)C(=O)c2c(noc2C)C
|
|
927
|
CN(C)C1CCC(CC1)/C=C/C2C3C(NCCN3)NC(N2)N
|
|
928
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
929
|
C=CC[C@@H]1CC=C[C@H](N1C(=O)c2[nH]ccn2)c3ccccc3
|
|
930
|
|
|
931
|
|
|
932
|
c1ccc2c(c1)C[C@@H]([C@@H]2Sc3ncccn3)O
|
|
933
|
Cc1cccc(n1)C#CCNc2ccccc2
|
|
934
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
935
|
c1ncn(n1)C(=O)NC2CCCCC2
|
|
936
|
c1ccc2c(c1)-c3c(nc4ccccc4n3)C5=NNNN25
|
|
937
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
938
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
939
|
Cc1nc(cn1Cc2ccc(cc2)F)c3ccc4ccccc4n3
|
|
940
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
941
|
c1ccnc(c1)CS(=O)(=O)[O-]
|
|
942
|
C1Cc2c(nc(nc2c3c4c(nc(n3)N)CCC4)N)C1
|
|
943
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
944
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
945
|
|
|
946
|
CC1(C=C(c2cc(ccc2C1=O)C#N)NC(=O)c3ccccn3)C
|
|
947
|
CC1=C2C(=N[C@@H]1c3ccncc3)CCNC2=O
|
|
948
|
c1ccc(cc1)C2=NCCNC(=O)C2
|
|
949
|
CNc1c2c(nccn2)ncn1
|
|
950
|
c1ccc2c(c1)nc3c(n2)C4=CC=CC5=CC=C[C@@H]3[C@@H]54
|
|
951
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
952
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
953
|
CCC(CC)Nc1c(nc(c(n1)C)Oc2cc(ccn2)C)C
|
|
954
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
955
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
956
|
C1CC[C@@H]2[C@@H](C1)NC(=O)C(=N2)CCC(=O)[O-]
|
|
957
|
c1ccc2c(c1)Cc3nc(=O)c4ccccc4n3C2
|
|
958
|
c1cc(oc1)c2nc([nH]n2)N
|
|
959
|
CC[C@@H]1c2c(c3ccccc3oc2=O)Oc4c1c(=O)[nH]c(n4)C
|
|
960
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
961
|
CCOC(=O)c1c(c2c(cccc2s1)F)Cn3cnc(n3)C#N
|
|
962
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
963
|
COC(=O)c1cccc2n1ncn2
|
|
964
|
Cc1ccc(cc1)c2ncns2
|
|
965
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
966
|
CCOC(=O)N/C=CNC(=O)OCC
|
|
967
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
968
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
969
|
COc1ccc(cc1c2cccc(c2)OC3(CCCC3)C(=O)[O-])F
|
|
970
|
c1ccc(cc1)[C@@H]2OCc3c(ccc(n3)CO)O2
|
|
971
|
CCn1cncc1c2nnc3n2cccc3Cl
|
|
972
|
Cc1c2c(n(n1)c3ccccc3)-c4ccccc4S2(=O)=O
|
|
973
|
CCn1cc(cn1)c2cncn2CCCC(C)(C)CO
|
|
974
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
975
|
Cc1nn(c(=O)n1N)Cc2nnc(s2)Nc3ccccc3
|
|
976
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
977
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
978
|
COc1cc(cc(c1OC)Cl)/C=C/[C@@H](c3ccccc3O2)O
|
|
979
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
980
|
c1ccc(cc1)C2=NC(=O)[C@@]([N-]2)(C(F)(F)F)Nc3nccs3
|
|
981
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
982
|
Cc1cc(no1)c2nnc(o2)N
|
|
983
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
984
|
COC(=O)[C@@H](Cc1cncn1Cc2cc(cc(c2)Cl)Cl)N
|
|
985
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
986
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
987
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
988
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
989
|
Cc1c(oc(n1)Cn2c(=O)c3ccccc3nn2)C
|
|
990
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
991
|
CC(C)S(=O)(=O)c1cscc1NC(=O)Nc2ccccc2
|
|
992
|
c1cscc1c2cnc(c(n2)N3CCC[C@@H](C3)CCCO)N
|
|
993
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
994
|
CCOC1NC(=O)N(S1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
995
|
c1coc(n1)NC(=O)[C@H]2[C@H]3C[C@@H]([C@@H]2C(=O)[O-])C=C3
|
|
996
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
997
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
998
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
999
|
CCN1c2cscc2S(=O)(=O)N(C1=O)Cc3ccccn3
|
|
1000
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
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