(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
2
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
3
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
4
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
5
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
6
|
Cc1c(=O)nc2n(n1)cnc3n2nc(c3)c4ccccc4
|
|
7
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
8
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
9
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
10
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
11
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
12
|
CNc1nc(nc(n1)n2cnc(n2)SC)NC
|
|
13
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
14
|
|
|
15
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
16
|
COc1cc(nc(c1)C(=O)Nc2[n-]nnn2)c3ccc(cc3)N
|
|
17
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
18
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
19
|
Cc1cc(nc(n1)N)n2c(cc(n2)c3ccco3)C(F)(F)F
|
|
20
|
CN1CCc2c(c(nc3c2c(n[nH]3)N)Nc4ccc(cc4)OC)C1
|
|
21
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
22
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
23
|
c1ccnc(c1)c2cn(nn2)C3CCN(CC3)C(=O)C4CC4
|
|
24
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
25
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
26
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
27
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
28
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
29
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
30
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
31
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
32
|
Cc1c2c(nc(n1)n3cc(nn3)c4ccccc4)CCCC2
|
|
33
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
34
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
35
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
36
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
37
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
38
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
39
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
40
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
41
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
42
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
43
|
Cc1nc(cs1)c2cc(no2)CO
|
|
44
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
45
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
46
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
47
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
48
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
49
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
50
|
COc1c2cn[nH]c2ncn1
|
|
51
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
52
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
53
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
54
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
55
|
Cc1ccc(cc1)c2nnn(n2)c3c4c(c5ccccc5o4)ncn3
|
|
56
|
|
|
57
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
58
|
CCCCSc1nc(c2nc3ccccc3c(=O)n2n1)[O-]
|
|
59
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
60
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
61
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
62
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
63
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
64
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
65
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
66
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
67
|
Cc1cc(no1)c2cc(=O)[nH]c(n2)SC
|
|
68
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
69
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
70
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
71
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
72
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
73
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
74
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
75
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
76
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
77
|
c1c(c(n(n1)C(=O)CCN2CCOC2=O)N)C#N
|
|
78
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
79
|
Cc1nnn(n1)Cc2nnnn2C
|
|
80
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
81
|
Cn1ccnc1COc2ccc(cc2)N
|
|
82
|
Cc1cc(nc(n1)Nc2c(nn[nH]2)C(=O)C)C
|
|
83
|
Cc1cc(nc(n1)Sc2nc(nc(n2)Cl)NC)C
|
|
84
|
Cc1c(c2nc(c3c(n2n1)OCC3)C(=O)[O-])c4ccccc4
|
|
85
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
86
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
87
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
88
|
Cn1cc(c(n1)c2ccncc2)c3ccc4c(c3)C(=O)NC4
|
|
89
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
90
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
91
|
c1ccc2c(c1)ncc(n2)c3cnc(nc3c4ccncc4)N
|
|
92
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
93
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
94
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
95
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
96
|
Cc1[nH]c(=O)c2c3c(c(=O)oc2n1)nns3
|
|
97
|
CN1c2ccc(cc2-c3n[nH]c(=O)c(=O)n3CC1=O)Cl
|
|
98
|
Cc1csc(n1)c2nnc(o2)N
|
|
99
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
100
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
101
|
Cn1cnc2c(c1=O)n(nc2C(=O)[O-])c3ccc(cc3)F
|
|
102
|
Cc1cc(c(o1)C)c2cnnc(n2)N3CC[C@@H](C3)COC
|
|
103
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
104
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
105
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
106
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
107
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
108
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
109
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
110
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
111
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
112
|
c1nc2c(c(n1)[O-])nsc2C(=O)[O-]
|
|
113
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
114
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
115
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
116
|
Cn1c(=O)c(nn(c1=O)c2ccccc2)c3nc(on3)[O-]
|
|
117
|
Cc1cc(nn2c1nnc2)n3c(nc(n3)N)N
|
|
118
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
119
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
120
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
121
|
c1cscc1c2cnc(c(n2)N3CCC[C@@H](C3)CCCO)N
|
|
122
|
Cc1cc(nc(n1)n2c(c(c(=O)c(n2)C)c3ccccc3)N)C
|
|
123
|
c1cc(oc1)c2ccnc(n2)N
|
|
124
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
125
|
CCOC(=O)c1c2nc([nH]n2cn1)C(=O)C
|
|
126
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
127
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
128
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
129
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
130
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
131
|
Cc1c(c(n(n1)C)n2cncn2)N
|
|
132
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
133
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
134
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
135
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
136
|
c1cnn2c1ncc3c2C(=O)OCC3
|
|
137
|
c1cnc(cn1)c2nnc(o2)N
|
|
138
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
139
|
CCSC1C2C(CN[NH]2)NCN1
|
|
140
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
141
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
142
|
c1cnc(nc1c2nccs2)N
|
|
143
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
144
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
145
|
Cc1ccc(n1c2[n-]c(nn2)SCCCC(=O)[O-])C
|
|
146
|
Cn1c2c([nH]c1=O)nncn2
|
|
147
|
C[C@@]1(C(=O)Nc2ccccc2O1)c3nc(no3)c4ccncc4
|
|
148
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
149
|
c1ccc(cc1)n2nc3ccc4c(c3n2)nc(cn4)N
|
|
150
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
151
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
152
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
153
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
154
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
155
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
156
|
Cc1cc2nc(nc(n2n1)N)N
|
|
157
|
Cn1c(=O)c(c(cn1)[C@@H](C#N)c2[nH]c3ccccc3n2)Cl
|
|
158
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
159
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
160
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
161
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
162
|
|
|
163
|
c1cnn(c1)c2cncc(n2)Cl
|
|
164
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
165
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
166
|
c1cnccc1c2cc3c(o2)CCNC3=O
|
|
167
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
168
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
169
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
170
|
Cc1cc(n(n1)c2nc(c(nn2)C)[O-])C
|
|
171
|
|
|
172
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
173
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
174
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
175
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
176
|
CN(C)c1nnnn1c2ncccn2
|
|
177
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
178
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
179
|
c1ccc2c(c1)-c3c(nc4ccccc4n3)C5=NNNN25
|
|
180
|
C=C1/C(=C/C2CCCS2)/C(=O)N([NH]1)C3CCCCC3
|
|
181
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
182
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
183
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
184
|
c1ccc(c(c1)C(=O)[O-])Sc2c(nccn2)Cl
|
|
185
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
186
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
187
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
188
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
189
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
190
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
191
|
CCOC(=O)c1[nH]nc(n1)N
|
|
192
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
193
|
CCO[C@@H]1C2C(NC3CCCCC3N2)-C4CCCCC4N1C(=O)C
|
|
194
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
195
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
196
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
197
|
|
|
198
|
Cc1c(c(nc(n1)C)SCc2nnc(s2)SC)C(=O)C
|
|
199
|
c1ccc2c(c1)-c3c(nc4nnnn4n3)C2=O
|
|
200
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
201
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
202
|
CCN(CC)/C(=C/C(=O)OCC)/C1CC([NH]C1C)C
|
|
203
|
c1ccc2c(c1)c-3nc4ccc(cc4[nH]n3c2=O)N
|
|
204
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
205
|
c1cc(ccc1c2c(nn3c2OCCC3)c4ccncc4)F
|
|
206
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
207
|
Cn1c(c(c(=O)n(c1=O)C)n2c(nnn2)N(C)C)N
|
|
208
|
CN1c2cnc(nc2-c3c(ccs3)S1(=O)=O)N
|
|
209
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
210
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
211
|
C[C@@H](Cn1cc(cn1)Cl)c2cc(=O)[nH]c(n2)NC(C)C
|
|
212
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
213
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
214
|
CC(C)c1nnc(o1)c2cc3c(nn(c3s2)C)C(F)(F)F
|
|
215
|
Cc1cc(=O)n2c(n1)sc(n2)n3cnc(n3)C#N
|
|
216
|
c1ccc(cc1)c2ccc(cc2)c3cc(c4c(n3)ocn4)C(=O)[O-]
|
|
217
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
218
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3c(=O)ccc(n3)c4ccco4
|
|
219
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
220
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
221
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
222
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
223
|
C[C@@H]1c2c[nH]nc2-c3ccccc3N1S(=O)(=O)c4ccccn4
|
|
224
|
c1cnccc1C2c3c(c(n[nH]c3=O)[O-])Nc4c2c(=O)[nH]nc4[O-]
|
|
225
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
226
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
227
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
228
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
229
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
230
|
|
|
231
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
232
|
C=C1/C(=C/C2=CC3CCCCC3OC2)/C(=O)N([NH]1)C4CCCCC4
|
|
233
|
c1c(nc(cn1)Cl)n2cncn2
|
|
234
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
235
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
236
|
c1cc(ccc1C(=C2C=CC(=N)C=C2)c3ccc(cc3)N)N
|
|
237
|
c1cc(cc(c1)Cl)c2nnn(n2)c3ccc4nnnn4n3
|
|
238
|
Cc1cc(=O)[nH]c(n1)C2CC2
|
|
239
|
Cc1c(oc(n1)SCC(=O)[O-])C
|
|
240
|
c1ccc2c(c1)Nc3cc(cnc3S2)C(=O)[O-]
|
|
241
|
c1cc2c(c(c(o2)c3ccncc3)c4ccc(cc4)F)nc1
|
|
242
|
CC(=O)Nc1nccc(n1)c2cc(no2)c3ccccc3
|
|
243
|
[H]/N=c/n(cc(o1)c2ccc(cc2)CC)c3nc(cc(n3)C)C
|
|
244
|
c1cc(ccc1C2=C(N=CC2)c3ccncc3)F
|
|
245
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
246
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
247
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
248
|
Cc1nc(no1)c2cccc(c2)S(=O)(=O)NCC(=O)[O-]
|
|
249
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
250
|
CC(=O)C1C2C(NC(N1)C(=O)C)N(CN2)C(=O)C
|
|
251
|
COC(=O)N1CCC(CC1)c2cc(=O)[nH]s2
|
|
252
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
253
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
254
|
|
|
255
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
256
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
257
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
258
|
CCOC(=O)CCC1NC(C(C2N1NNN2)C)C(=O)OCC
|
|
259
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
260
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
261
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
262
|
CCn1c(c(c2c1nc3ccccc3n2)c4[nH]c5ccccc5n4)N
|
|
263
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
264
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
265
|
c1ccc2c(c1)[nH]c(=O)c(n2)n3ccnc3
|
|
266
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
267
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
268
|
c1ccc2c(c1)ncc(n2)C#N
|
|
269
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
270
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
271
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
272
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
273
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
274
|
Cc1nc(cs1)c2ccc[nH]2
|
|
275
|
c1cc(oc1)c2nc(on2)CO
|
|
276
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
277
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
278
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
279
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
280
|
c1ccc2c(c1)NCCC(=N2)c3ccco3
|
|
281
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
282
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
283
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
284
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
285
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
286
|
CC1=N[C@@H](C(=N[C@@H](C1)c2ccc(cc2)Cl)C#N)C#N
|
|
287
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
288
|
Cc1ccc(c(c1)n2cccn2)c3c4c(nc[nH]4)ncn3
|
|
289
|
CCc1c(nco1)C(=O)N2CCC(CC2)c3cc(=O)[nH]c(n3)C
|
|
290
|
Cc1c2c(n3c(n1)c(cn3)C#N)N(CC2)Cc4ccco4
|
|
291
|
Cc1cc(c(o1)C)c2csc(n2)NC(=O)C
|
|
292
|
CCC(=O)Nc1cnn(c1)Cc2nnnn2CCOC
|
|
293
|
Cc1nc(cs1)c2nnc(o2)N
|
|
294
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
295
|
CCNC(=O)n1cc(c(n1)c2ccccc2)c3ccncn3
|
|
296
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
297
|
COC(=O)Nc1cn2c(n1)ccc(n2)C(=O)N
|
|
298
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
299
|
Cc1cc(nc(n1)Nc2ncc(n2c3ccccc3)O)C
|
|
300
|
|
|
301
|
c1ccc2c(c1)[nH]c(n2)c3c(c4cccnc4s3)[O-]
|
|
302
|
c1ccc(cc1)c2nc(sn2)n3ccc(n3)C(F)(F)F
|
|
303
|
CN(C)c1nc(nc(n1)OC)n2cc(nn2)c3ccccc3
|
|
304
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
305
|
c1ccnc(c1)SCCn2cccn2
|
|
306
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
307
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
308
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
309
|
CCOC(=O)c1c(c2c(nc(nc2n1C)c3ccccc3)C)N
|
|
310
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
311
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
312
|
C1C(=O)CC2NN[NH]N2C1N
|
|
313
|
|
|
314
|
Cc1c(nnn1c2nc(nc(n2)OC)N(C)C)C(=O)C
|
|
315
|
Cc1c2c(nc3ccccc3n2)n(n1)c4nccs4
|
|
316
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
317
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
318
|
C[C@@H](c1ccccc1)N(C)Cc2nccn2C
|
|
319
|
CCCNC(=O)Cc1nc[nH]n1
|
|
320
|
c1cc(oc1)c2nsc(=O)o2
|
|
321
|
Cc1nc2c(s1)-c3c(cnc(n3)Nc4ccc(nc4)OC)CC2
|
|
322
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
323
|
Cc1[nH]nc(n1)c2ccccc2
|
|
324
|
c1c(=O)nc2n(n1)c(cs2)N
|
|
325
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
326
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
327
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
328
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
329
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
330
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
331
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
332
|
CCSc1nnc(s1)N/C(=C/Sc2ncccn2)/[O-]
|
|
333
|
CCc1cc2c(cnc(c2o1)OC)C(=O)Nc3c(cncn3)C#N
|
|
334
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
335
|
c1ccc2c(c1)nn(n2)c3cc(n[nH]3)O
|
|
336
|
CCOC(=O)[C@@H]1C2C(NC3CCCCC3N2)N4[C@@H]1CCC4
|
|
337
|
CC1NC(ON1)C2CNCCN2
|
|
338
|
CCOC(=O)c1nc(nc(n1)C(=O)OCC)C(=O)OCC
|
|
339
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
340
|
Cc1cc(n2c(n1)ncn2)n3ccnc3
|
|
341
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
342
|
COc1ccc(cc1OC2CCCC2)c3ccc(nc3)C(=O)N
|
|
343
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
344
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
345
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
346
|
CC1([C@@H]2CC[C@]1(c3c2nc(c(n3)C#N)C#N)C(=O)[O-])C
|
|
347
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
348
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
349
|
Cc1cc(co1)C(=O)n2ccnc2
|
|
350
|
Cc1cc(sn1)NC(=O)c2ccco2
|
|
351
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
352
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
353
|
C1CC(OC1)C2CNC3C(N2)C(NC(N3)N)N
|
|
354
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
355
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
356
|
c1ccc2c(c1)[nH]c(n2)c3ccco3
|
|
357
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
358
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
359
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
360
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
361
|
CCSc1ccc(nn1)N
|
|
362
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
363
|
CC(=O)N1CCC(CC1)c2c(cnc(n2)C3CC3)c4ccncc4
|
|
364
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
365
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
366
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
367
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
368
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
369
|
c1ccc2c(c1)ncc(n2)c3cc(c(nc3c4ccncc4)O)C#N
|
|
370
|
CNc1c(ncnn1)C(=O)[O-]
|
|
371
|
CSc1nc(c(nn1)c2ccco2)c3ccco3
|
|
372
|
Cn1c2c(cn1)nc([nH]2)c3ccccc3
|
|
373
|
c1cc(cnc1)C(=O)c2c3c(ccs3)nc(n2)C(F)(F)F
|
|
374
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
375
|
c1c2c(n[nH]c1=O)CCCC2
|
|
376
|
Cn1cccc1/C=C/2C(=NC(=O)N2)[O-]
|
|
377
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
378
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
379
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
380
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
381
|
CC(C)(C)c1cc(c(s1)C(=O)OC)CSc2ccccn2
|
|
382
|
c1ccc2c(c1)c3c(nn2)nn4c(=O)cc(nc4n3)C(F)(F)F
|
|
383
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
384
|
CCCCCCC1CN[NH]N1
|
|
385
|
|
|
386
|
C=CCSc1nc2c(c(n1)c3cccs3)CCCC2
|
|
387
|
|
|
388
|
Cn1c(=O)c2ccccc2c(n1)C(=O)[C@@H](C#N)c3ccccn3
|
|
389
|
c1c(nc(=O)n(n1)[C@@H]2CCCO2)N
|
|
390
|
Cc1cnc(c(n1)Cl)C#N
|
|
391
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
392
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
393
|
Cc1cc(sn1)[C@@H](c2ccc(cc2)C(C)C)Nc3cccnc3
|
|
394
|
C1C[C@@H](OC1)C(=O)Nc2[n-]nnn2
|
|
395
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
396
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
397
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
398
|
c1ccc2c(c1)C(=O)C(C2=O)(c3c([nH]c(=O)[nH]c3=O)[O-])O
|
|
399
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
400
|
Cc1cc(nc(n1)n2c(=O)ccc(n2)[O-])C
|
|
401
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
402
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
403
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
404
|
|
|
405
|
c1cc(c(cc1c2ccc(c(c2)O)N)O)N
|
|
406
|
c1cc(oc1)c2nc(nc(=[N+]3CCOCC3)o2)N4CCOCC4
|
|
407
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
408
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
409
|
Cc1cc2nc(nc(=O)n2o1)Oc3ccccc3
|
|
410
|
C[C@@H]1C(=O)N=C(N1c2nc(nc(n2)OC)NC(C)C)N
|
|
411
|
Cc1c(c(nn1C)n2cnnc2)NS(=O)(=O)c3c[nH]cn3
|
|
412
|
Cc1c(cnc(n1)C2CC2)c3nc(sn3)Nc4ccccc4
|
|
413
|
C[C@@H](Nc1nccs1)n2cncn2
|
|
414
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
415
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
416
|
|
|
417
|
COC(=O)n1c(=O)c2ccccc2c(n1)OC(=O)OC
|
|
418
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
419
|
CSc1cc(nn1C(=O)Cc2ccccc2)c3ccc(cc3)F
|
|
420
|
C1CCC(CC1)/C=C/C=C/C2C(=O)[NH]C(=O)[NH]N2
|
|
421
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
422
|
CC1CCCC(N1)C2[N-]NNN2
|
|
423
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
424
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
425
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
426
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
427
|
Cc1ccc(cc1)n2c3c[nH]c(=O)nc3cn2
|
|
428
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
429
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
430
|
Cc1ncc(s1)CN(C)[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
431
|
c1ccc(cc1)c2cc(nc(n2)C(=O)Nc3[n-]nnn3)O
|
|
432
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
433
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
434
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
435
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
436
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
437
|
c1ccc(cc1)C2=CC(=Nn3c(nnn3)N2)c4ccccc4
|
|
438
|
Cc1ccc2c(c1)[C@@]3(C(=O)c4ccccc4[C@@]3(O2)O)O
|
|
439
|
|
|
440
|
CC1(C[C@@H](C(=O)C1)[C@@]23COC(=O)C(=C2C=C3)CO)C
|
|
441
|
CNC(=O)c1c2c(ccs2)nc(n1)NCc3cccnc3
|
|
442
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
443
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
444
|
CC(=O)N1CCC(CC1)c2nc3c(c(n2)[O-])nccn3
|
|
445
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
446
|
CC1([C@H]([C@@H](c2cc(ccc2C1=O)C#N)Oc3ccccn3)O)C
|
|
447
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
448
|
CC1CC2C(CC1C)N(C3C(C(=O)[NH]C(N3)N)C2(C)C)C
|
|
449
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
450
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
451
|
|
|
452
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
453
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
454
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
455
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
456
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
457
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
458
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
459
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
460
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
461
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
462
|
C[C@@H]1CCC2C(C(=O)[NH]C(N2)N)N1
|
|
463
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
464
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
465
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
466
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
467
|
COc1ccc(cc1)n2c3ccccc3nc2Cn4cnc(n4)C#N
|
|
468
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
469
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
470
|
Cc1nc(cn1Cc2ccc(cc2)F)c3ccc4ccccc4n3
|
|
471
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
472
|
c1ccc(cc1)n2c(c(c(nc2=O)Cn3cncn3)C#N)N
|
|
473
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
474
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
475
|
COC(=O)C1=NC(=N)N=C(C12c3ccccc3CC2=O)C(=O)OC
|
|
476
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
477
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
478
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
479
|
Cc1cc2nc(cc(=O)n2o1)N(C)Cc3ccsc3
|
|
480
|
c1ccc(cc1)c2cc3c(nccn3n2)Cl
|
|
481
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
482
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
483
|
c1cc(cnc1)c2cc(c3c(n2)nc(nc3[O-])N)C(F)(F)F
|
|
484
|
CCOC(=O)c1nn(c2n1c(=O)c(nn2)C)c3ccccc3
|
|
485
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
486
|
c1nc-2[nH]c(c(nc2n1)N)[O-]
|
|
487
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
488
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
489
|
Cc1cc(nc(n1)Sc2ccc(nn2)Cl)C
|
|
490
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
491
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
492
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
493
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
494
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
495
|
CC(C)(C)C1=C(N2[C@H](O1)[C@@H](C2=O)[C@@H](c3ccncc3)O)C(=O)[O-]
|
|
496
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
497
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
498
|
Cc1cc(n(n1)C(=O)c2c(nns2)C)C
|
|
499
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
500
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
501
|
Cc1c(snn1)c2[nH]c3ccccc3n2
|
|
502
|
|
|
503
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
504
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
505
|
Cc1c(nc([nH]1)c2[nH]c(c(n2)C)C)C
|
|
506
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
507
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
508
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
509
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
510
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
511
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
512
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
513
|
|
|
514
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
515
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
516
|
c1ccc2c(c1)[nH]c(=O)n2c3csc(n3)c4ccncc4
|
|
517
|
CSc1nc2ncnn2c(n1)[O-]
|
|
518
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
519
|
COC(CNC1=Nc2c(cccn2)OC1)OC
|
|
520
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
521
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
522
|
c1c(nn2c1OCCC2)CO
|
|
523
|
|
|
524
|
Cc1cc(n(n1)C(C)C)OC(=O)N(C)C
|
|
525
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
526
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
527
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
528
|
c1ccc(cc1)c2c(c3ccc(nc3[nH]2)C(=O)[O-])C4CCCCC4
|
|
529
|
COC(=O)c1cc(nc2c1c(=O)n3cc[nH]c3n2)C4CC4
|
|
530
|
c1ccc(cc1)n2cc(nn2)c3nc(on3)c4ccc5cc[nH]c5c4
|
|
531
|
c1cc(oc1)c2cc(no2)CO
|
|
532
|
Cc1cc(=O)n2c(n1)sc(n2)Sc3ncnn3N
|
|
533
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
534
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
535
|
c1c2c(n[nH]c1=O)CCOC2
|
|
536
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
537
|
Cc1cc(no1)CSc2nncs2
|
|
538
|
|
|
539
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
540
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
541
|
CC(=O)/N=c/c(nn(s1)C(=O)C)C(=O)N
|
|
542
|
Cc1ccccc1[C@@H]2N=C(Nc3n2c4ccccc4c(=O)n3)N
|
|
543
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)S2
|
|
544
|
c1cc(sc1)c2cc3c(=O)[nH]ncn3n2
|
|
545
|
CC1CCC(CC1)S(=O)(=O)C2CN[NH]N2
|
|
546
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
547
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
548
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
549
|
CCOC(=O)c1cnn2c1nnn(c2=O)c3ccccc3
|
|
550
|
c1ccc(cc1)c2cnccn2
|
|
551
|
Cc1c(n(c-2n/c(=[NH+]/c3ccccc3)/ncc2n1)c4ccccc4)C
|
|
552
|
|
|
553
|
c1cnc(nc1)SCc2cc(=O)c(co2)O
|
|
554
|
c1ccc(cc1)c2c(scn2)Cn3cnc4cnccc4c3=O
|
|
555
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
556
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
557
|
c1ccc(cc1)c2nnn(n2)n3nc(nn3)c4ccccc4
|
|
558
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
559
|
Cc1cc(n(n1)c2ncccn2)C
|
|
560
|
c1ccc(cc1)S(=O)(=O)Oc2ccccc2c3nnco3
|
|
561
|
|
|
562
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
563
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
564
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
565
|
Cc1ccc(cc1)c2nc(c(nn2)C)Sc3ccc(cc3)F
|
|
566
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
567
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
568
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
569
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
570
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
571
|
C1CCC(CC1)C(=O)NN2CCNN2
|
|
572
|
c1cc(c(cc1S(=O)(=O)[O-])C(=O)[O-])c2cn[nH]c2[O-]
|
|
573
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
574
|
C12C(NC(S1)C(=O)[O-])SC(N2)C(=O)[O-]
|
|
575
|
|
|
576
|
c1ccnc(c1)c2ccc(s2)NC(=O)N3CCOCC3
|
|
577
|
COc1ccc(c(c1)O)c2c(cn[nH]2)c3ccccc3OC
|
|
578
|
|
|
579
|
c1nc2c(c(n1)N)N=C[C@H]2[C@@H]3[C@@H]([C@H]([C@@H](O3)CO)O)O
|
|
580
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
581
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
582
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
583
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
584
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
585
|
c1ccc(cc1)SCc2cc(=O)c(co2)O
|
|
586
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
587
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
588
|
c1cc(oc1)c2cc(on2)N
|
|
589
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
590
|
Cc1cc(nc2c1c(nn2C)n3c(c(nn3)C#N)N)C
|
|
591
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
592
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
593
|
c1ccc2c(c1)N3CCCN2c4c3cc(nn4)Cl
|
|
594
|
COCCCn1cnc2c(c1=O)c3c(o2)nc4ccccc4n3
|
|
595
|
CCCCN1c2cccnc2-c3c(cccn3)N=C1c4ccccc4
|
|
596
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
597
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
598
|
c1cocc1/C=C/2C(=NC(=O)N2)[O-]
|
|
599
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
600
|
CC(C)(C)OC(=O)N1CCn2c(nnc2C(=O)[O-])C1
|
|
601
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
602
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
603
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
604
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
605
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
606
|
c1nc2c(s1)c(=O)[nH][nH]c2=O
|
|
607
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
608
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
609
|
[H]/N=C/[C@@H](c2c(nc3ccccc3n2)Sc4ccccc4N1)C#N
|
|
610
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
611
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
612
|
C1CCC(CC1)C(=O)C2C3CCCCC3C4N2C(=O)[NH]C(=O)[NH]4
|
|
613
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
614
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
615
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
616
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
617
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
618
|
[H]/N=c/1[nH]nc2c(n1)-c3ccccc3C2=O
|
|
619
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
620
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
621
|
Cc1c(cn(n1)C)c2nnc(s2)NC
|
|
622
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
623
|
CN(C)C1CCC(CC1)/C=C/C2C3C(NCCN3)NC(N2)N
|
|
624
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
625
|
CC1C2C(C([NH]1)C3CCCCC3)NC(OC2=O)C
|
|
626
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
627
|
CC1(Cc2c(n3c(c2C#N)nc(cn3)c4ccccc4)CO1)C
|
|
628
|
c1cc(nc2c1NC(=O)C2)F
|
|
629
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
630
|
COC(=O)c1c2c(nnc(n2nc1C(=O)OC)[O-])c3ccccc3
|
|
631
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
632
|
Cc1cc(no1)N[C@@]2(C(=O)[C@@H](C(=N2)C)C#N)C(F)(F)F
|
|
633
|
CSC1NSC2N1C(NN2)N
|
|
634
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
635
|
c1c[nH]nc1c2nccs2
|
|
636
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
637
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
638
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
639
|
c1cc(cc(c1)Cl)n2c(=O)c3c(nc2[O-])non3
|
|
640
|
c1ccc(cc1)c2nn3c(=O)c4ccccc4nc3o2
|
|
641
|
Cc1csc(n1)c2c(nns2)C
|
|
642
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
643
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
644
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
645
|
c1cc(sc1)c2[nH]ccn2
|
|
646
|
c1c[nH]c2c1ncc(n2)Cl
|
|
647
|
Cc1cc(n(n1)c2nc(nc(n2)OC)n3c(cc(n3)C)C)C
|
|
648
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
649
|
Cc1cc(nc(n1)n2c(cc(=O)[nH]c2=O)N)C
|
|
650
|
Cc1ccc(cc1)c2nn3c4c(nc5c(n4)non5)nc3s2
|
|
651
|
c1cnnc(n1)c2nccnn2
|
|
652
|
|
|
653
|
c1ccc(cc1)c2cn(nn2)CC(=O)[O-]
|
|
654
|
C1CC(OC1)C2C3C(CNNC3OC2C4CCCO4)N
|
|
655
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
656
|
CC1CCN(CC1)c2ncc3c(n2)-c4cn(nc4NCC3)C
|
|
657
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
658
|
CC(C)(C)Nc1[n-]c(c(n1)C#N)C#N
|
|
659
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
660
|
CSc1nc2c(c(n1)NCCCO)SCCC2
|
|
661
|
CC1=Nc2c(c(nc(n2)N3CCCCC3)N)C1=O
|
|
662
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
663
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
664
|
CC1C(NN2C(NC(C2N1)C(=O)N)C)C
|
|
665
|
c1cc(c(nc1)c2ccco2)N
|
|
666
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
667
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
668
|
c1cc(oc1)c2csc3c2c(=O)[nH]cn3
|
|
669
|
Cc1c(oc(n1)Cn2nc(nn2)c3ccccc3)C
|
|
670
|
c1cnoc1NC(=O)N2CCOCC2
|
|
671
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
672
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
673
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
674
|
c1ccc(cc1)Oc2ccccc2c3cc4c(nc3)nn[nH]4
|
|
675
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
676
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
677
|
CC1(Cc2ccccc2-c3n1c4c(c3)nc5ccccc5n4)C
|
|
678
|
c1ccc(cc1)c2c(=O)cc3n(n2)c(=O)c4ccccc4s3
|
|
679
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
680
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
681
|
c1ccc(cc1)/C/2=N/CCOC(=O)c3c2cccc3
|
|
682
|
Cn1c2c(cn1)c(ncn2)n3cccn3
|
|
683
|
C([C@H](c1c(c(c(o1)O)[O-])O)O)O
|
|
684
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
685
|
|
|
686
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
687
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
688
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
689
|
CC1NC2C(S1)NC(NN2)C3CCCCC3
|
|
690
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
691
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
692
|
Cc1c2c(n[nH]1)Oc3c(c(c(c(=O)[nH]3)C#N)N)[C@@H]2c4ccccc4
|
|
693
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
694
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
695
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
696
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
697
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
698
|
c1nncn1c2[n-]c(nn2)N
|
|
699
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
700
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
701
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
702
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
703
|
Cc1c(=O)n2c(nn1)sc(n2)c3ccco3
|
|
704
|
Cc1nc2n(n1)C3=CC(CC(=O)C3=NN2)(C)C
|
|
705
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
706
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
707
|
Cc1c(c2nnc3c(n2n1)csc3NC(=O)C)c4ccccc4
|
|
708
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
709
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
710
|
|
|
711
|
c1cnc(cn1)NC23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
712
|
CCc1nc(n(c(=O)n1)c2ccccc2)N3CCOCC3
|
|
713
|
|
|
714
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
715
|
CSc1c2c3c(c(cc(=O)[nH]3)[O-])sc2nc(n1)N
|
|
716
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
717
|
Cc1nn2cc(nc2s1)Cn3cnc4c(c3=O)cccc4OC
|
|
718
|
c1ccc(cc1)/C=C/2NC(=O)C(=O)O2
|
|
719
|
c1ccc2c(c1)cnn(c2=O)Cc3ccon3
|
|
720
|
c1cc(sc1)c2c(nc([nH]2)[C@@H]3CCC=CC3)c4cccs4
|
|
721
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
722
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
723
|
c1cnc(c2c1scc2)C#CCO
|
|
724
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
725
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
726
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
727
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
728
|
c1cnn2c1nc(cc2)Cl
|
|
729
|
|
|
730
|
c1ccc(cc1)C2=CC(NC=N2)(c3ccccc3)c4ccccc4
|
|
731
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
732
|
CC1(OC[C@@H]([C@@H](O1)[C@@H](C2[NH]C(C(N2)C#N)OC)O)O)C
|
|
733
|
Cc1c(sc2c1/c(=[NH+]/Cc3cn4ccccc4n3)/nc[nH]2)C
|
|
734
|
c1ccc(cc1)c2nnn(n2)CCS(=O)(=O)N3CCOCC3
|
|
735
|
Cc1csc(=O)n1CCn2nc(nn2)c3ccccc3
|
|
736
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
737
|
C[C@@H]1Cc2nc(cc(=O)n2N1c3ccccc3)[O-]
|
|
738
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
739
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
740
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
741
|
CCCC[C@@H]1N=C2C(=NC=N2)c3n1nc(n3)c4cccnc4
|
|
742
|
c1cc(sc1)c2cc(c(nc2c3nccs3)[O-])C#N
|
|
743
|
Cc1c(c[nH]n1)c2ccccc2
|
|
744
|
COC(=O)c1cc2c([nH]1)cc(nc2Cl)Cl
|
|
745
|
c1cc(oc1)c2c(nc(c(n2)C#N)C#N)c3ccco3
|
|
746
|
CNC(=O)c1c(n(nn1)C)Sc2c(nns2)C(=O)NC
|
|
747
|
c1cc2c(nc1)OCC(=O)N2
|
|
748
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
749
|
|
|
750
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
751
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
752
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
753
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
754
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
755
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
756
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
757
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
758
|
c1ccc(cc1)c2nc(=[NH2+])sn2c3ccccc3
|
|
759
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
760
|
Cc1cn(c(n1)c2cccnc2)c3ccc(cc3)S(=O)(=O)C
|
|
761
|
CC1C2C(NC(NC2C([NH]1)C3CCCCC3)C)C
|
|
762
|
CN(C)S(=O)(=O)[N-]c1nc(nc(n1)Cl)Cl
|
|
763
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
764
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
765
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
766
|
Cc1cn2c(n1)sc(n2)NCC=C
|
|
767
|
c1ccc(cc1)c2c(nc3c(n2)c(nnc3N)N)c4ccccc4
|
|
768
|
CC(=O)NSC[C@@H](C(=O)[O-])NC(=O)OC(C)(C)C
|
|
769
|
CC1C2C(NC(NN2)N3CCOCC3)N(N1)C4CCCCC4
|
|
770
|
c1ccc2c(c1)CCC(=C2)c3cccnc3
|
|
771
|
c1cc(oc1)Cn2c(=O)c3cnc(nc3nc2[O-])n4ccnc4
|
|
772
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
773
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
774
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
775
|
C1CC([NH]C1)C(=O)OCC#N
|
|
776
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
777
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
778
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
779
|
Cc1cc(no1)/N=c/c(nss2)Cl
|
|
780
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
781
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
782
|
Cn1c(=O)c2c3c(c[nH]n3)oc2n(c1=O)C
|
|
783
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
784
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
785
|
CS(=O)(=O)NCc1ccccn1
|
|
786
|
C1CCc2c(nc(nn2)N)C1
|
|
787
|
Cc1nc2c(c(n1)N3CCCC3)CN(CC2)C(=O)C
|
|
788
|
c1csc(n1)n2cnnn2
|
|
789
|
c1ccc2c(c1)OCc3cc(ccc3O2)N
|
|
790
|
CC(C)S(=O)(=O)c1c(c(=O)[nH]s1)c2ccccc2
|
|
791
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
792
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
793
|
Cc1nc(no1)c2cc(sc2)S(=O)(=O)NC3CC3
|
|
794
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
795
|
CCn1cc(cn1)c2cc[nH]n2
|
|
796
|
|
|
797
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
798
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
799
|
Cc1c(c(n(n1)Cc2[n-]nnn2)C)Br
|
|
800
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
801
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
802
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
803
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
804
|
c1cnccc1c2nc3n(n2)CCC3
|
|
805
|
c1cc2c(cc1C#N)C[C@@H](O2)c3ccc(o3)Br
|
|
806
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
807
|
c1cc2c(nc1)n(nn2)[O+]=C(N)N
|
|
808
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
809
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
810
|
Cc1csc(n1)c2cn[nH]c2N
|
|
811
|
COC(=O)Nc1cn2ccccc2n1
|
|
812
|
CCOC(=O)Cn1nc(nn1)CSc2ccc(cc2)Cl
|
|
813
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
814
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
815
|
CCc1c2c(n(n1)C3CCCC3)-c4nnc(n4CC2)C
|
|
816
|
C1CCC(CC1)NC2C(C(=O)SS2)CL
|
|
817
|
c1csc(n1)n2cc(c(=O)[nH]c2=O)C#N
|
|
818
|
Cn1c(nnn1)SCc2cnc(s2)c3ccccc3
|
|
819
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
820
|
CCOC(=O)CCc1c2c([nH]c1C(=O)OCC)CNC(=O)C2
|
|
821
|
CC1[NH]C(=O)C(CN1)CC=C
|
|
822
|
c1cc(oc1)c2csc(n2)CC#N
|
|
823
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
824
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
825
|
Cn1c(c(cn1)c2nc(no2)C3CC3)N
|
|
826
|
c1ccc2c(c1)nc(o2)c3c[nH]nc3
|
|
827
|
Cc1c(c(n(n1)C)Sc2ccccn2)N
|
|
828
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
829
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
830
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
831
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
832
|
c1ccc(cc1)c2nc(on2)c3csnn3
|
|
833
|
c1cc(oc1)c2nc([nH]n2)N
|
|
834
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
835
|
CN1C2C(C(=O)N(C1=O)C)NC3C4CCCCC4OC3N2
|
|
836
|
CC(C)N1C(=O)C2NN3C(C(=O)N(C3=O)C(C)C)NN2C1=O
|
|
837
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
838
|
Cc1ncc(s1)CN(C)Cn2c(=O)oc(n2)c3ccccc3
|
|
839
|
CC1(C(=O)N(C(=N1)O)CC(=O)[O-])C
|
|
840
|
Cc1cccc(c1n2cnc(nc2=O)NC)C
|
|
841
|
COc1ccc(cc1c2cccc(c2)OC3(CCCC3)C(=O)[O-])F
|
|
842
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
843
|
c1[nH]c(=O)c2c(n1)c(c3n2CCCC3)C#N
|
|
844
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
845
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
846
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
847
|
c1ccnc(c1)/C=C/c2ccco2
|
|
848
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
849
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
850
|
CC(C)(C)OC(=O)N1CC[C@@](C1)(CSc2ccncc2)O
|
|
851
|
Cc1c(cc(o1)C(=O)[O-])Sc2ccccc2C(=O)[O-]
|
|
852
|
Cc1ccc(n1c2c(ccs2)c3cc([nH]n3)N)C
|
|
853
|
c1ccc2c(c1)[nH]c(n2)n3cnnc3
|
|
854
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
855
|
c1cc(sc1)C(=O)n2cnnc2N
|
|
856
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
857
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
858
|
c1c2c(nc(n1)N)SCC2
|
|
859
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
860
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
861
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
862
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
863
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
864
|
|
|
865
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
866
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
867
|
Cn1cc2c(c1c3ccc(cc3)N)c(=O)[nH]nc2[O-]
|
|
868
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
869
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=O)NC(=[NH+]2)N3CCCCC3
|
|
870
|
Cc1nc(on1)c2c(non2)N
|
|
871
|
c1c(=O)nc2n(n1)C(=O)CS2
|
|
872
|
c1cc(cnc1)c2cc([nH]n2)NC(=O)c3cnns3
|
|
873
|
CCOC1NNC(S1)CSC2CCCCN2
|
|
874
|
c1cc(sc1)C(=O)n2cccn2
|
|
875
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
876
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
877
|
c1cc(nn2c1ncc2)Cl
|
|
878
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
879
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
880
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
881
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
882
|
C[C@@H]1Nc2ccccc2-c3c(nc(nn3)SC)O1
|
|
883
|
CSC1C2C(NC(N1)SC)N=CCN2
|
|
884
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
885
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
886
|
c1c[nH]nc1C(=O)NC2CC2
|
|
887
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
888
|
CCCCN1Cc2c(nc3cc(nn3c2[O-])C(C)(C)C)C1=O
|
|
889
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
890
|
CCN(CC)C1C(NNC2N1NC3C2CCCN3)C
|
|
891
|
CC(C)(C)c1ccc(=O)[nH]n1
|
|
892
|
C[C@@H]1C[C@@H]2C3=C(C1)C=NC(=C[C@@]34C[C@@H](CC=C4O2)O)OC
|
|
893
|
c1c(=O)nc2n3c1NC(=O)C[C@@]3(CS2)O
|
|
894
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
895
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
896
|
CCC(=O)Nc1ncccn1
|
|
897
|
|
|
898
|
CC[C@@H](c1cnn(c1)C)NC(=O)c2c(ocn2)C
|
|
899
|
CSc1nc(nc(=[N+]2CCOCC2)s1)c3ccccc3
|
|
900
|
c1cc(oc1)C(=O)/C=C/2C(=O)NCCN2
|
|
901
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
902
|
c1c2c(nc(nc2oc1C(=O)[O-])C(F)(F)F)[O-]
|
|
903
|
CC(=O)NC1NCNC(N1)N
|
|
904
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
905
|
C1CCC2C(C1)NC3C(N2)NSN3
|
|
906
|
Cc1ccc(nc1)n2cnnn2
|
|
907
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
908
|
c1cc(cnc1)c2cc3c(ncnc3o2)NC(=O)C4CC4
|
|
909
|
|
|
910
|
CC1C(OC(N1)NC(=O)N(C)C2CC2)C
|
|
911
|
Cn1c(nnn1)/N=C(/c2ccc(o2)Br)[O-]
|
|
912
|
c1c2c(nc(n1)N)CCCC2=O
|
|
913
|
|
|
914
|
c1cnccc1N2C(=O)C3=C(S2(=O)=O)CCCC3
|
|
915
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
916
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
917
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
918
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
919
|
Cc1c(non1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)O[C@@H]3CO
|
|
920
|
C1CC2C(NC1)SC3CNNCC3N2
|
|
921
|
CCN1C(NN2C(C1=O)NC3CCCCC3C2=O)C
|
|
922
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
923
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
924
|
c1nc(nn1CC(=O)N)C#N
|
|
925
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
926
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
927
|
CC(C)(C)S(=O)(=O)c1cn[nH]c1N
|
|
928
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
929
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
930
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
931
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
932
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
933
|
Cc1c2c(ccc(n2)NC(=O)C)n(n1)C
|
|
934
|
CN(C)S(=O)(=O)OC1CCC(CC1)N
|
|
935
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
936
|
CCO[C@@H]1C(C(=NC(=O)N1)[O-])(F)F
|
|
937
|
Cc1nc(c(c(n1)SC)C#N)n2cccc2
|
|
938
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
939
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
940
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
941
|
Cc1c(cn(n1)c2ccccn2)N3C[C@@H](CC3=O)C(=O)[O-]
|
|
942
|
C[C@@H]1C[C@@H](n2c(ncn2)N1)c3ccccc3
|
|
943
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
944
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
945
|
Cc1cc(no1)c2nnc(o2)N
|
|
946
|
c1c[nH]nc1C(=O)Nc2nccs2
|
|
947
|
Cc1c(nc(nc1N2CCC=CC2)C3CC3)NC4CC4
|
|
948
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
949
|
Cc1nc(c2n1nc[nH]c2=O)CC(C)C
|
|
950
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
951
|
c1ccc2c(c1)C(=NC(=O)c3ccccc3N2)c4cccc(c4)O
|
|
952
|
Cc1cccc(c1)/N=C/2CNC(=NC2=O)[O-]
|
|
953
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
954
|
c1cc(ccc1[C@@H](c2c(nc3nnc(n3n2)N)[O-])C(=O)[O-])Cl
|
|
955
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
956
|
Cc1c(c(nc(c1Cl)C)S(=O)(=O)NC2CC2)C#N
|
|
957
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
958
|
C(C1[N-]NNN1)C2[N-]NNN2
|
|
959
|
Cc1c(nnc(c1c2c(cc(cn2)C(F)(F)F)Cl)O)C
|
|
960
|
|
|
961
|
c1ccc(cc1)c2nn(c(=O)o2)CN3CCOCC3
|
|
962
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
963
|
c1ncn(n1)Sn2cncn2
|
|
964
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
965
|
COc1ccc2c(n1)cc([nH]2)C=C
|
|
966
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
967
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
968
|
CC1NC(NO1)C2(CCCC2)NC(=O)C
|
|
969
|
c1nc([nH]n1)c2c(non2)N
|
|
970
|
c1ccc(c(c1)C(=O)[O-])S[C@@H]2CCC(=O)N2
|
|
971
|
c1c(c(c(=O)n(n1)Cc2c(snn2)Cl)Cl)Cl
|
|
972
|
Cn1c(c(nc1Sc2cccs2)C#N)C#N
|
|
973
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
974
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
975
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
976
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
977
|
|
|
978
|
CCCCc1[nH]cc([nH+]1)CO
|
|
979
|
c1ccnc(c1)C#CCN2CCCCC2
|
|
980
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
981
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
982
|
c1c2c(n[nH]1)[C@H]3[C@@H]([C@@H](C2=O)CC3=O)NCCC#N
|
|
983
|
c1cnn(c1)Cn2cc(cn2)N
|
|
984
|
COc1ccccc1n2c(coc2=O)c3ccc(cc3)F
|
|
985
|
|
|
986
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1c3ccccc3)c4ccco4
|
|
987
|
C1CC(C1)C(=O)N([C@H]2CC(=NC2=O)[O-])C3CC3
|
|
988
|
Cc1ccc(nc1)C[S@@](=O)C2=NC3=CS[C@H](C3=N2)C(=O)C
|
|
989
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
990
|
Cc1cc2n(c(c(s2)C(=O)C)[O-])c(=[NH2+])n1
|
|
991
|
Cc1[nH]n2c(n1)c(c3c2nc4ccccc4n3)C(=O)NCCOC
|
|
992
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
993
|
c1ccc(cc1)CS(=O)(=O)n2ccnc2
|
|
994
|
CS(=O)(=O)c1cnccn1
|
|
995
|
CCOC(=O)C=NN=C/C1=N/NSC2CCC(CC2)C
|
|
996
|
Cc1c2c(n(n1)c3ccccc3)N[S@@](=O)N2
|
|
997
|
c1ccc2c(c1)C=Nc3c(ncnc3O2)N4CCOCC4
|
|
998
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
999
|
CC(C)(C)OC(=O)Nc1c[nH]nc1
|
|
1000
|
C/C(=C/C(=NC(=NC1=O)O)O)/Nc2cccc(c2)C(F)(F)F
|
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/ | ||||||||