(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
|
2
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
|
3
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
|
4
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
|
5
|
c1ccc2c(c1)nnn2Cc3nc4ccccc4s3
|
|
|
6
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
|
7
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
|
8
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
|
9
|
c1ccc2c(c1)C(=O)C(C2=O)(c3c([nH]c(=O)[nH]c3=O)[O-])O
|
|
|
10
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
|
11
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
|
12
|
CC(C)S(=O)(=O)c1cscc1NC(=O)Nc2ccccc2
|
|
|
13
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
|
14
|
CC1=C(NC(=O)NN1)/N=C/2C=CC=CC2=O
|
|
|
15
|
CCCCCNC1=[NH+]C(=N/C(=C/C=C(C=CC2=O)Cl)/N1)N
|
|
|
16
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
|
17
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
|
18
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
|
19
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
|
20
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
|
21
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
|
22
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
|
23
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
|
24
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
|
25
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
|
26
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
|
27
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
|
28
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
|
29
|
CC1(C=C(c2cc(ccc2C1=O)C#N)NC(=O)c3ccccn3)C
|
|
|
30
|
|
|
|
31
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
|
32
|
CC1=C(Oc2ccccc2N1)C(=O)Nc3ccccc3
|
|
|
33
|
Cc1cc([nH]c1/C=C/C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
34
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
|
35
|
c1ccc2c(c1)c(=O)c(c(s2)N)c3[nH]c4ccccc4n3
|
|
|
36
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
|
37
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
|
38
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
|
39
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
|
40
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
|
41
|
CC[C@@H](CCC(=O)/N=c/ccn([nH]1)c2ccccc2)C(=O)[O-]
|
|
|
42
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
|
43
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
|
44
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccccn3)O
|
|
|
45
|
c1ccc(cc1)n2cc(nc2)NC(=O)n3ccccc3=O
|
|
|
46
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
|
47
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
48
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
49
|
c1ccc(cc1)[C@H]2[C@@H]3CCCO[C@@H]3NC(=O)N2
|
|
|
50
|
Cncc([nH]/c1=NC(=O)Nc2ccc(cc2)O)[O-]
|
|
|
51
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
|
52
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
|
53
|
Cc1ccc(cc1)c2nnn(n2)CCn3c4ccccc4oc3=O
|
|
|
54
|
Cc1cc2c([nH]1)ccc3c2non3
|
|
|
55
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
|
56
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
|
57
|
CCSc1nnc(o1)c2c(nc3n2ccs3)C
|
|
|
58
|
c1cc(cnc1)CNCCc2ccco2
|
|
|
59
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
|
60
|
Cc1nccc(n1)Sc2ccccc2
|
|
|
61
|
COc1ccc(cc1)NC(=O)NC2=C(CCC2)C(=O)OC
|
|
|
62
|
c1cnc(c(n1)C#N)NCc2nc3c(s2)CCCC3
|
|
|
63
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
|
64
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
|
65
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
|
66
|
c1ccnc(c1)NC(=O)Nc2cccc3c2-c4cccn4C3=O
|
|
|
67
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
|
68
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
|
69
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
|
70
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
|
71
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
|
72
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
|
73
|
Cc1c(c[nH]n1)c2nc(sn2)Nc3ccccc3
|
|
|
74
|
Cn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
75
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
|
76
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
|
77
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
78
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
|
79
|
c1ccc2c(c1)ncn2/C=C/NC(=O)c3ccc(cc3)Cl
|
|
|
80
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
|
81
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
|
82
|
CC=C(C(=O)N/C1=C/c2ccccn2)C
|
|
|
83
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
|
84
|
CC(C)NC(=O)c1ccc(o1)c2cncnc2
|
|
|
85
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
|
86
|
CC1=C[C@@](NC(=O)N1)(C)[C@@]2(C=C(NC(=O)N2)C)C
|
|
|
87
|
Cc1ccc(cc1OS(=O)(=O)c2c([nH]c(=O)s2)C)C(C)C
|
|
|
88
|
Cc1cc(=O)n2c(n1)SCC(=N2)N
|
|
|
89
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
|
90
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
|
91
|
|
|
|
92
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
|
93
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
|
94
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
|
95
|
Cc1csc(n1)SCC2=NS(=O)(=O)c3ccccc3N2
|
|
|
96
|
c1ccc(cc1)NC(=O)N/C=C/c2cccs2
|
|
|
97
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
|
98
|
c1ccc(cc1)C#CNCCOc2ccccn2
|
|
|
99
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
|
100
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
|
101
|
C[C@@H](N1CCNC1)OCCCC2CCCCC2
|
|
|
102
|
CC1=C([C@@H](N2C(=N1)NC=N2)c3ccccn3)C(=O)N
|
|
|
103
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
|
104
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
|
105
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
|
106
|
CN1C(NCN1)CCC2CCCCC2
|
|
|
107
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
|
108
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
|
109
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
|
110
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
|
111
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
|
112
|
Cc1ccc(cc1)c2ncc(o2)Sc3ccccc3
|
|
|
113
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
|
114
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
|
115
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
|
116
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
|
117
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
|
118
|
|
|
|
119
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
|
120
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
|
121
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
|
122
|
CCOC(=O)c1c(c(cn1C)NC(=O)OCc2ccccc2)O
|
|
|
123
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
124
|
c1ccc(cc1)[C@@H]2NC(=[NH2+])Nc3n2c4ccccc4n3
|
|
|
125
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
|
126
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
|
127
|
C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NCCCc4[n-]nnn4)C
|
|
|
128
|
c1cc(sc1)[C@@H]2[C@@H](C(=NC(=O)N2)[O-])C#N
|
|
|
129
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
|
130
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
|
131
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
|
132
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
|
133
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
|
134
|
C1CCC(CC1)C(=O)C2C3CCCCC3C4N2C(=O)[NH]C(=O)[NH]4
|
|
|
135
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
|
136
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
|
137
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
|
138
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
|
139
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
|
140
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
|
141
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
|
142
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
|
143
|
c1ccc(cc1)n2cc(cn2)c3c4cc(ccc4on3)F
|
|
|
144
|
C1CC[C@H](NCC1)N/C=C/C2=CCCCC2
|
|
|
145
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
|
146
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
|
147
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
|
148
|
Cc1c(n(c(c1c2[nH]c3ccccc3n2)N)C4CCCC4)C
|
|
|
149
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
|
150
|
C1CCC(CC1)C(=O)C#CC2C[NH]C(=O)[NH]C2=O
|
|
|
151
|
CCOC(=O)N/C=CNC(=O)OCC
|
|
|
152
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
|
153
|
c1cc(sc1)Sc2nc(ns2)Cl
|
|
|
154
|
CCN1CC(=O)N=C1NCCc2cccc(c2)Cl
|
|
|
155
|
Cc1cc(=O)n2c([nH]1)c(c(n2)NC)c3nc(no3)c4ccccc4
|
|
|
156
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
|
157
|
c1ccc(cc1)Cn2cnnn2
|
|
|
158
|
Cc1c(c([nH]n1)N)[C@@](c2nccn2C)(C(F)(F)F)O
|
|
|
159
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
160
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
|
161
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
|
162
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
|
163
|
C[C@@H]1c2nc(nn2[C@](C(=O)O1)(C)CC#C)[C@@H](C)O
|
|
|
164
|
CC(C)c1nc(cs1)CNC(=O)c2c(ocn2)C3CC3
|
|
|
165
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
166
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
|
167
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
|
168
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
|
169
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
|
170
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
|
171
|
C[C@@H]1C2=C(COC2=O)NC(=O)N1
|
|
|
172
|
CN1CC(CN1)NC(=O)CCN2CCOC2=O
|
|
|
173
|
c1cc2c(nc1)n(nn2)[O+]=C(N)N
|
|
|
174
|
COc1ccc(cc1)/N=C/Cc2nc(c(s2)C#N)C(F)(F)F
|
|
|
175
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
|
176
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
|
177
|
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
|
|
|
178
|
Cc1c(non1)OCCNC(=O)C23CC4CC(C2)CC(C4)C3
|
|
|
179
|
CCn1c(c(c2c1nc3ccccc3n2)c4[nH]c5ccccc5n4)N
|
|
|
180
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
|
181
|
CC1CCCC(C1)N2C(=O)NC3C(C(=O)N(C(=O)N3C)C)N2
|
|
|
182
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
|
183
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
|
184
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
|
185
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
|
186
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
|
187
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
|
188
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
|
189
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
|
190
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
|
191
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
|
192
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
|
193
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
|
194
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
|
195
|
C1C2NC(=O)NC1NC(=O)N2
|
|
|
196
|
c1cc(cc(c1)N/C=c/2ccc3c4c2cccc4c(=O)n3)C(=O)[O-]
|
|
|
197
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
|
198
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
|
199
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
|
200
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
|
201
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
|
202
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
|
203
|
c1csc2c1[nH]c(=O)oc2=O
|
|
|
204
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
|
205
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
|
206
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
|
207
|
c1ccc(cc1)NC(=O)/C=c/2c(nc3n2c4ccccc4n3)O
|
|
|
208
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
|
209
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
|
210
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
|
211
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
|
212
|
|
|
|
213
|
C1CCC2C(C1)C3C([NH]2)C(=O)CCS3
|
|
|
214
|
c1ccc(cc1)Cn2cncn2
|
|
|
215
|
c1ccc(cc1)c2nc(cs2)Cn3c4ccccc4nn3
|
|
|
216
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
|
217
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
|
218
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
|
219
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
|
220
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
|
221
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
|
222
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
|
223
|
C[C@H]([C@@H]1[C@@H](NC1=O)CC(=O)OC)O
|
|
|
224
|
c1cc(sc1)NC(=O)NCC2CC2
|
|
|
225
|
COC(=O)CC1(C(=O)NC(=O)N=C1[O-])CC(=O)OC
|
|
|
226
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
|
227
|
c1ccc2c(c1)c(ns2)NCc3cccs3
|
|
|
228
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
|
229
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
|
230
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
|
231
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
|
232
|
CC1NC(ON1)CC2CCCS2
|
|
|
233
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
|
234
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
|
235
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
|
236
|
c1ccc2c(c1)CC[NH+]=C(N2)N3CCOCC3
|
|
|
237
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
|
238
|
c1ccnc(c1)NC(=O)Nc2cccc3c2[C@@H]4CCCN4C3=O
|
|
|
239
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
|
240
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
|
241
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
|
242
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
|
243
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
|
244
|
Cc1ccc(cc1)NC(=O)c2nnc(s2)Cn3ccnc3
|
|
|
245
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
|
246
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
|
247
|
Cc1nc(c2cccn2n1)Cl
|
|
|
248
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
|
249
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
|
250
|
|
|
|
251
|
c1c(c([nH]n1)N)C2=CCCCC2
|
|
|
252
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
|
253
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
|
254
|
Cc1cc(n(n1)C(=O)c2c(nc(s2)Nc3ccccc3)C)C
|
|
|
255
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
|
256
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
|
257
|
|
|
|
258
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
|
259
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
|
260
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
|
261
|
Cc1c2c(n[nH]1)CC(C=C2)(C)C
|
|
|
262
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
|
263
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
|
264
|
Cc1csc(n1)Sc2nc(ns2)Cl
|
|
|
265
|
COC(=O)c1ccc(cc1)NC(=O)/C=c/2[nH]s[nH]c(=C)n2N
|
|
|
266
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
267
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
|
268
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
|
269
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
|
270
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
|
271
|
C[C@@H]1CCCN(C1)C(=O)c2c(c(ns2)c3ccccn3)N
|
|
|
272
|
|
|
|
273
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
274
|
CNC(=O)N/C=C/c1ccco1
|
|
|
275
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
|
276
|
c1csc2c1ncnc2N
|
|
|
277
|
COc1nc(nc(n1)Sc2ccc(cc2)N)OC
|
|
|
278
|
C1CN2C(NC1=[NH2+])O[C@@H]3[C@H]2C[C@@H]([C@H]3O)CO
|
|
|
279
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
|
280
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
|
281
|
c1cc(sc1)CCNc2ncccn2
|
|
|
282
|
CC1=CNC(=O)CC(C1)(C)C
|
|
|
283
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
|
284
|
Cc1cccc(n1)C#CCNc2ccccc2
|
|
|
285
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
|
286
|
CC1(C=CN(C(=O)O1)c2ccccc2)C
|
|
|
287
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
|
288
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
|
289
|
C1CCc2c(c3c(c([nH]c3s2)C#N)N)C1
|
|
|
290
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
|
291
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
|
292
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
|
293
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
|
294
|
c1cc(cnc1)c2cc([nH]n2)NC(=O)c3cnns3
|
|
|
295
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
|
296
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
|
297
|
Cc1ccccc1OCC(=O)Nn2c(nnn2)Nc3ccccc3
|
|
|
298
|
Cc1c(ccnc1COc2nc3ccccc3o2)OCC(C)C
|
|
|
299
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
|
300
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
|
301
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
|
302
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
|
303
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
|
304
|
CC1(OC(=O)C(C(=O)O1)CN/C=C/C2=CCCCC2)C
|
|
|
305
|
CCOC(=O)N1CCNC(=O)C1
|
|
|
306
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
|
307
|
c1ccc(cc1)/C=C/C#Cc2ccccc2
|
|
|
308
|
c1c(c2c([nH]c1=O)CCC2)[O-]
|
|
|
309
|
c1c(cnc2c1COC(=O)N2)Br
|
|
|
310
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
|
311
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
|
312
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
|
313
|
Cc1c2c([nH]n1)C(=O)N([C@@H]2c3ccco3)C
|
|
|
314
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
|
315
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
316
|
C1CCC2C(C1)C[C@@H]3C[C@H]2OC3=O
|
|
|
317
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
|
318
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
|
319
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
|
320
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
|
321
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
|
322
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
|
323
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
|
324
|
c1ccc(cc1)NC(=O)OCc2cncs2
|
|
|
325
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
|
326
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
|
327
|
Cc1c(c(n[nH]1)C)Sc2ccccc2
|
|
|
328
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
|
329
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
|
330
|
Cc1cc(=O)[nH]c2c1CCO2
|
|
|
331
|
c1cc(sc1)c2ccn[nH]2
|
|
|
332
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
|
333
|
CC1(COC2CC(CC3C2N1NN3)N)C
|
|
|
334
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
|
335
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
|
336
|
CN(C)S(=O)(=O)[N-]c1nc(nc(n1)Cl)Cl
|
|
|
337
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
|
338
|
Cn1cnc2c1ccnc2C(=O)NCC(=O)[O-]
|
|
|
339
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
|
340
|
COC(=O)N1CCCNC(=O)C1
|
|
|
341
|
c1cc2c(nc3ccsc3n2c1)N4CCC=CC4
|
|
|
342
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
|
343
|
Cc1ccc(cc1)S(=O)(=O)N/C(=N/c2[nH]ncn2)/[O-]
|
|
|
344
|
CC1(C(=O)O[C@@H]2[C@@H](CCN2C(=O)O1)O)C
|
|
|
345
|
CCOC(=O)C1=C(C(=O)NCC1)[O-]
|
|
|
346
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
|
347
|
c1ccc(cc1)Oc2nc3ccccn3c(=O)n2
|
|
|
348
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
|
349
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
|
350
|
CC(=O)NCCc1coc2c1ccnc2
|
|
|
351
|
Cc1ccc(cc1)c2nc(no2)n3c4ccccc4nn3
|
|
|
352
|
COC(=O)Nc1c(ccs1)OCc2ccc(cc2)Cl
|
|
|
353
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
|
354
|
Cc1nc2cccc3c2n1CCN3
|
|
|
355
|
CCCNC(=O)Cc1nc[nH]n1
|
|
|
356
|
CC1=C(CC(=O)N1)C(=O)OC
|
|
|
357
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
|
358
|
c1ccc2c(c1)c3c([nH]2)CCC3
|
|
|
359
|
CC(=O)Nc1cc2cccnc2sc1=O
|
|
|
360
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
|
361
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
|
362
|
|
|
|
363
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
|
364
|
Cc1ccc(cc1)S(=O)(=O)Nn2c3ccccc3nn2
|
|
|
365
|
CC1=C[C@@H](CC(=O)N1)c2ccco2
|
|
|
366
|
c1ccc2=NC3=[NH+]CCN3C(=c2c1)[O-]
|
|
|
367
|
c1c(nc2n1CCS2)CNC(=O)[C@@H]3CC(=O)OC34CCCC4
|
|
|
368
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
369
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
|
370
|
CCc1nnc(o1)Cn2cnc3ccccc3c2=O
|
|
|
371
|
c1nc(c2n1CC(=O)NC2)C(=O)N
|
|
|
372
|
CC(=O)N[C@@H](CS/N=N/c1ccccc1)C(=O)[O-]
|
|
|
373
|
C1CCC(CC1)CC2CCC[NH]2
|
|
|
374
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
|
375
|
Cc1cc(c(c(c1)C)OS(=O)(=O)Nc2cccnc2)C
|
|
|
376
|
C1CC([NH]C1)C(=O)OCC#N
|
|
|
377
|
CC1=C[C@@H](c2c(=O)[nH]c(=O)[nH]c2O1)c3ccccc3
|
|
|
378
|
Cc1c(cn(n1)CC=C)CNCc2c(nns2)C
|
|
|
379
|
CNc1cnnc2c1cccc2
|
|
|
380
|
c1ccc(cc1)NC(=O)Nc2csc(n2)c3ccncc3
|
|
|
381
|
CS(=O)(=O)NCCOc1ccccc1
|
|
|
382
|
CC(C)(C)S(=O)(=O)c1cn[nH]c1N
|
|
|
383
|
Cn1c(nnn1)SCc2cnc(s2)c3ccccc3
|
|
|
384
|
c1cc(sc1)c2[nH]ccn2
|
|
|
385
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
|
386
|
c1ccc2c(c1)nc3n2[C@@H](NC(=[NH+]3)N)c4ccco4
|
|
|
387
|
CCOC(=O)C1=C(N=C(N[C@H]1c2ccccc2)O)C
|
|
|
388
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
|
389
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
|
390
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
|
391
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
|
392
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
|
393
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
|
394
|
CCOC(=O)C1=C(NC(=O)N[C@@H]1C)c2cccs2
|
|
|
395
|
c1ccc(cc1)CNc2cnccn2
|
|
|
396
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
|
397
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
|
398
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
|
399
|
|
|
|
400
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
|
401
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
|
402
|
CC1=Nc2c(cnn2C)C(=O)CC1
|
|
|
403
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
|
404
|
c1ccc(cc1)C2=NCCNC(=O)C2
|
|
|
405
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
|
406
|
c1cc(cnc1)c2nc3c4c(ncn3n2)CCC4
|
|
|
407
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
|
408
|
CCNC(=O)Cn1ccnc1
|
|
|
409
|
CC1(CC(=O)N[C@@H]1/C=C/C(CC(=O)N2)(C)C)C
|
|
|
410
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
|
411
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
|
412
|
CCCCCCC1CN[NH]N1
|
|
|
413
|
Cn1cc(c(n1)C(F)(F)F)COC(=O)Nc2ccccc2
|
|
|
414
|
Cc1ccc(nc1)n2cnnn2
|
|
|
415
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
|
416
|
Cc1nc(cn1Cc2ccc(cc2)F)c3ccc4ccccc4n3
|
|
|
417
|
C1CC(C1)C(=O)N([C@H]2CC(=NC2=O)[O-])C3CC3
|
|
|
418
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
|
419
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
|
420
|
Cc1ccc(cc1)c2nc(on2)c3cc4ccccc4[nH]3
|
|
|
421
|
c1ccc2c(c1)CCN(C2)Cn3c(ncn3)c4ccccc4Cl
|
|
|
422
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
|
423
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
|
424
|
Cc1c(cnc(n1)C)C(=O)C
|
|
|
425
|
Cc1c2ccccc2nc(n1)C
|
|
|
426
|
c1cc(cnc1)c2cc3c(ncnc3o2)NC(=O)C4CC4
|
|
|
427
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
|
428
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
|
429
|
c1cc(cc(c1)Cl)n2ccc(n2)c3cnccn3
|
|
|
430
|
Cc1cccc(c1)NC(=O)N2C[C@@H]3C[C@H]2C=C3
|
|
|
431
|
c1ccn2c(c1)nc3c2C(=O)CC3
|
|
|
432
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
|
433
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
|
434
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
|
435
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
|
436
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
|
437
|
c1ccc(cc1)CCN2CC3=C(CCCC3=O)NC2
|
|
|
438
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
|
439
|
CSc1[nH]c(=O)c2c(n1)CCS2
|
|
|
440
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
441
|
c1ccc2c(c1)nnn2C3=[NH+]CCN3
|
|
|
442
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
|
443
|
C1Cc2c(nnc(c2C(F)(F)F)[O-])C1
|
|
|
444
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
|
445
|
c1ccc2c(c1)CC(=O)NC=C2
|
|
|
446
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
|
447
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
|
448
|
c1ccc(cc1)CSC2=Nc3ccc(cc3C(=O)[C@H]2C#N)F
|
|
|
449
|
c1ccc(cc1)c2nnnn2C3(CCCCC3)n4cccn4
|
|
|
450
|
c1ccc2c(c1)nc(c3n2ccc3)n4cccc4
|
|
|
451
|
c1cc2c(nc1C#N)CCCN2
|
|
|
452
|
|
|
|
453
|
c1csc2c1c(ncn2)n3ccnc3
|
|
|
454
|
|
|
|
455
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
|
456
|
CCCNC(=O)Nc1c(c(c(o1)C)C)C#N
|
|
|
457
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
|
458
|
|
|
|
459
|
c1ccc(cc1)C#CC(=O)c2cccs2
|
|
|
460
|
c1ccc(cc1)C(=O)/C=C/C(=O)Nc3c(cccn3)N2
|
|
|
461
|
C1CC2(C1)C[C@@](NC(=O)N2)(C(F)(F)F)O
|
|
|
462
|
COc1cccc(c1)C2=CCN(C(=O)N2)c3ccccc3O
|
|
|
463
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
|
464
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
|
465
|
[H]/N=C/NC(=[NH2+])C(C(=N1)[O-])(CC)CC
|
|
|
466
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
|
467
|
C1CCC(CC1)[C@@]23CCCN=C2NC(=O)CC3
|
|
|
468
|
Cc1nc-2c(s1)CCc3c2cccc3
|
|
|
469
|
|
|
|
470
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
|
471
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=O)NC(=[NH+]2)N3CCCCC3
|
|
|
472
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
|
473
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
|
474
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
|
475
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
|
476
|
c1ccc2c(c1)CC=N[C@@H]2Cn3c4ccccc4nn3
|
|
|
477
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
|
478
|
c1ccc2c(c1)nn(n2)Cc3nc4ccccc4s3
|
|
|
479
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
|
480
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
|
481
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
|
482
|
Cc1ccc(cc1)NC(=O)[C@@H]2CC(=O)n3cnnc3N2
|
|
|
483
|
Cc1cc(c(n1C)C)C(=O)COn2c3cc(ccc3nn2)Cl
|
|
|
484
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
|
485
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
|
486
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
|
487
|
Cnccs/c1=NC(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
|
488
|
Cc1nc(c(o1)n2cnc3c2cccc3)C#N
|
|
|
489
|
Cc1cc(=O)n2ccccc2n1
|
|
|
490
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
|
491
|
COc1c2c([nH]n1)nncn2
|
|
|
492
|
c1ccc2c(c1)nc3n2[C@@H](C=CS3)O
|
|
|
493
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
|
494
|
CC(C)(C)CN1C[C@@H](CC1=O)NC(=O)CCc2cnccn2
|
|
|
495
|
Cc1c(cco1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
|
496
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
|
497
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
|
498
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
|
|
499
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
|
500
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
|
501
|
CCOC(=O)[C@@H]1[C@@](C(=NC(=O)N1)[O-])(C)Br
|
|
|
502
|
CC(C)C1=C2CCCC[C@@H]2NC(=O)N1
|
|
|
503
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
|
504
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
|
505
|
Cc1ncc2c(n1)NC(=O)NC2
|
|
|
506
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
|
507
|
CC1CC2CC3CCCNN3C2NN1
|
|
|
508
|
Cc1c(non1)NCn2cnc3c2c(=O)n(c(=O)n3C)C
|
|
|
509
|
c1cc(nc2c1CNCC2)Cl
|
|
|
510
|
CCS(=O)(=O)N1CCC[C@@H](C1)C(=O)Oc2cccnc2
|
|
|
511
|
c1cc(cnc1)CCNCc2cscn2
|
|
|
512
|
Cc1cc2n(n1)C(=O)CC(=O)C2
|
|
|
513
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
|
514
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
|
515
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
|
516
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
|
517
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
|
518
|
C/C(=Nc1ccccc1)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
|
519
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
|
520
|
c1ccc(c(c1)[C@H]2[C@@H](CCC(=O)N2)NCC3=COCCO3)F
|
|
|
521
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
|
522
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
|
523
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
|
524
|
Cc1c(n2c(c1C#N)NCC2)C
|
|
|
525
|
CC1(Cc2c(c(n[nH]2)/C=C/c3ccccc3)C(=O)C1)C
|
|
|
526
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
|
527
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
|
528
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
|
529
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
|
530
|
c1ccc(cc1)NCCn2cccc2
|
|
|
531
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
|
532
|
CC(C)n1c2c(nn1)CCCC2
|
|
|
533
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
|
534
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
|
535
|
c1cc(oc1)c2cc(sc2)Nc3ccc(cc3)S(=O)(=O)N
|
|
|
536
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
|
537
|
Cn1cc(c(=O)n(c1=O)C)n2c(=O)n(c(=O)[nH]2)c3ccccc3
|
|
|
538
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
|
539
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
|
540
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
|
541
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
|
542
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
|
543
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
|
544
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
|
545
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
|
546
|
c1cnsc1C(=O)N2CC(C2)F
|
|
|
547
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
|
548
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
|
549
|
c1c[nH]nc1C(=O)Nc2nccs2
|
|
|
550
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
|
551
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
|
552
|
C1CCC(CC1)COC(=O)N[C@@H](CC(=O)N)C2[N-]NNN2
|
|
|
553
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
|
554
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
|
555
|
|
|
|
556
|
c1c2c(co1)[nH]c(=O)c(=O)[nH]2
|
|
|
557
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
|
558
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
|
559
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
|
560
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
|
561
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
|
562
|
Cc1c2c(=O)ccsc2c([nH]1)C
|
|
|
563
|
CC(=O)NCC1CNCCN1
|
|
|
564
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
|
565
|
Cc1nc(c(c(n1)Cl)NC2=NCCN2C(=O)C)Cl
|
|
|
566
|
CC(=O)c1cc(cnc1)OC
|
|
|
567
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
|
568
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
|
569
|
c1ccc(cc1)n2cc(cn2)Cn3cc(c(nc3=O)[O-])C#N
|
|