(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
|
2
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
|
3
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
|
4
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
|
5
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
|
6
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
|
7
|
CCNc1nc(nc(n1)Sc2ccc(cc2)C(=O)OC)N
|
|
|
8
|
CCOC(=O)Nc1cc2c(c(n1)N)N=C(CO2)c3ccccc3
|
|
|
9
|
Cc1ccccc1OCC(=O)Nn2c(nnn2)Nc3ccccc3
|
|
|
10
|
CCCCn1c(nnn1)NC(=O)N(C)Cc2nc(no2)CC
|
|
|
11
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
|
12
|
c1ccc(cc1)CCC2=N[C@H](C=C2)C(=O)c3ccc4c(c3)OCO4
|
|
|
13
|
c1ccc2c(c1)C3=NC(=N[C@H]3C2=O)C(=O)c4ccccc4C(=O)[O-]
|
|
|
14
|
c1ccc(cc1)N2CCN(CC2)Cc3nnnn3Cc4ccco4
|
|
|
15
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
|
16
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
|
17
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
|
18
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
|
19
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
|
20
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
|
21
|
c1ccc(cc1)OC(=O)N2CC=C(C=C2)n3c4ccccc4nn3
|
|
|
22
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
|
23
|
C[C@@H]1CCCC[C@@H]1NC(=O)COc2cnc(nc2)c3ccccc3
|
|
|
24
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
|
25
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
26
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
|
27
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
|
28
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
29
|
CCN1CC(=O)N=C1NCCc2cccc(c2)Cl
|
|
|
30
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
|
31
|
Cn1c(nnc1Sc2cnccn2)c3ccc(cc3)F
|
|
|
32
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
33
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
|
34
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
|
35
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
|
36
|
c1ccc(cc1)n2cc(nn2)c3nc(on3)c4ccc5cc[nH]c5c4
|
|
|
37
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
|
38
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
|
39
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
|
40
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
|
41
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
|
42
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
|
43
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
|
44
|
c1ccc2c(c1)ccn2Cc3nnc(s3)Cc4cccs4
|
|
|
45
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
|
46
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
|
47
|
|
|
|
48
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
|
49
|
c1ccc2c(c1)CN(c3cccnc3O2)c4ccc(s4)C(=O)[O-]
|
|
|
50
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
|
51
|
c1ccn(c1)c2c(c3c(s2)CN(CC3)c4cccc(n4)F)C#N
|
|
|
52
|
c1ccc(cc1)/C=C/Cn2c(=O)c3c(cccn3)oc2=O
|
|
|
53
|
C1CCC(CC1)C2C3CCCCC3C4N2C(=O)C[C@@H]4C(=O)[O-]
|
|
|
54
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
|
55
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
56
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
|
57
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
|
58
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
|
59
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
|
60
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
|
61
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
|
62
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
|
63
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
|
64
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
|
65
|
Cc1nnc(s1)SCN2CCN(CC2)c3ccccc3
|
|
|
66
|
CC[C@@H](CCC(=O)/N=c/ccn([nH]1)c2ccccc2)C(=O)[O-]
|
|
|
67
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
|
68
|
Cc1cn2c3c1CCCCn3c(n2)CN4CCCc5c4cccc5
|
|
|
69
|
c1cscc1c2cnc(c(n2)N3CCC[C@@H](C3)CCCO)N
|
|
|
70
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
|
71
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
72
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
|
73
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
|
74
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
|
75
|
C1CCC2C(C1)CC[C@@H]3N2[C@@H]4C5CCCCC5C(=O)N4CC3
|
|
|
76
|
|
|
|
77
|
Cc1ccc(cc1)c2nnn(n2)CCn3c4ccccc4oc3=O
|
|
|
78
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
|
79
|
|
|
|
80
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
|
81
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
|
82
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
|
83
|
C1CC(C(=O)N(C1)CC2NNC(O2)C3CC3)C(F)(F)F
|
|
|
84
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
|
85
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
|
86
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
|
87
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
|
88
|
Cc1ccc2nc(cn2c1)Cn3nc(nn3)c4ccccc4
|
|
|
89
|
C[C@@H]1CCc2c(c(on2)[C@@H]3CCCN(C3)C(=O)c4ccco4)C1
|
|
|
90
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
|
91
|
CC(C)(C)OC(=O)N1CCC(=CC1)c2cn(nn2)c3ccccc3
|
|
|
92
|
CCOC(=O)c1c(c2c(cccc2s1)F)Cn3cnc(n3)C#N
|
|
|
93
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
|
94
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
|
95
|
CCC(=O)c1cc(c(c(c1)Sc2cccc3c2nccc3)O)C
|
|
|
96
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
|
97
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
|
98
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
|
99
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
|
100
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
|
101
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
|
102
|
CCOC(=O)c1c(c(c([nH]1)c2c(nc3ccccc3n2)C)C#N)N
|
|
|
103
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
|
104
|
c1ccc(cc1)c2ncc(cn2)OC(=O)Cc3ccccc3F
|
|
|
105
|
CCNc1c(cc(c2c1nccc2)Cc3cnc(nc3N)N)C
|
|
|
106
|
COc1cccc(c1)C2=CCN(CC2)Cn3cnc(n3)C(=O)OC
|
|
|
107
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
|
108
|
C[C@@H](c1ccc(cc1)CC(C)C)/C(=N/S(=O)(=O)C)/[O-]
|
|
|
109
|
CC(=C)c1nc(nc(n1)Oc2ccccc2)Oc3ccccc3
|
|
|
110
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
|
111
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
|
112
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
|
113
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
|
114
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
|
115
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
|
116
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
|
117
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
|
118
|
CN1CC(=C(C1=O)O)c2ccc(cn2)Cc3ccc(cc3)F
|
|
|
119
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
120
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
|
121
|
CCn1c2ccccc2nc(c1=O)[C@H]3c4ccccc4NC3=O
|
|
|
122
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
|
123
|
c1cc(oc1)C(=O)N[C@@H]2CC(=O)c3c2ccs3
|
|
|
124
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
|
125
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
|
126
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
|
127
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
|
128
|
CC(=O)O[C@@H]1C=Cc2ccc3c4c2c1ccc4CC=C3OC(=O)C
|
|
|
129
|
C1CCC(CC1)N2C(=O)N3N(C2=O)-C4CC5CCCCC5CC4C3
|
|
|
130
|
Cc1c(c2nc(c3c(n2n1)OCC3)C(=O)[O-])c4ccccc4
|
|
|
131
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
|
132
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
|
133
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
|
134
|
Cn1c2c(cn1)c(ncn2)Sc3nnc(o3)c4cccnc4
|
|
|
135
|
c1ccc(cc1)n2cc(cn2)Cn3cc(c(nc3=O)[O-])C#N
|
|
|
136
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
|
137
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
|
138
|
CS(=O)(=O)N[C@@H]1CC(=O)N(C1)c2ccccc2
|
|
|
139
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
|
140
|
Cc1ccc(c(c1)c2cc(n[nH]2)C(=O)Nc3nnc(s3)C)O
|
|
|
141
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
|
142
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
|
143
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2sc(n3)N4CCCCC4)O
|
|
|
144
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
|
145
|
c1ccc2c(c1)C(=O)c3cccc4c3C2=NNS4(=O)=O
|
|
|
146
|
c1ccc2c(c1)-c3c4c(cccc4[nH]n3)C2=O
|
|
|
147
|
c1ccc(cc1)c2cn-3c([nH+]2)CCc4c3c5c(cccn5)cc4
|
|
|
148
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
|
149
|
|
|
|
150
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
|
151
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
|
152
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
|
153
|
c1ccc(cc1)S(=O)(=O)Nc2nncs2
|
|
|
154
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
|
155
|
Cc1ccc(cc1)Sc2c(cccn2)n3cccc3
|
|
|
156
|
c1ccc(cc1)CN2C[C@@H](c3c2ncc(n3)c4ccccc4)C#N
|
|
|
157
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
158
|
c1ccc(cc1)n2cc(cn2)CN3CCSc4c3cccc4
|
|
|
159
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
|
160
|
Cc1cc(nc(n1)Nc2nc(on2)COc3ccccc3)C
|
|
|
161
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
|
162
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
|
163
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
|
164
|
Cc1ccc(=O)n(c1)C(=O)c2cc(cc(n2)c3ccccc3)OC
|
|
|
165
|
CS(=O)(=O)NCc1ccccn1
|
|
|
166
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
|
167
|
Cc1cc(no1)Cn2nc(nn2)c3ccccc3
|
|
|
168
|
c1ccc(cc1)C2=CCNn3cnnc3S2
|
|
|
169
|
c1cc(ccc1c2c3c(c(ncn3)N4CCCC4)sn2)F
|
|
|
170
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
|
171
|
CN1CCN(CC1)C2=Cc3ccccc3Sc4c2cccc4
|
|
|
172
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
|
173
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
|
174
|
Cc1ncc(s1)CN(C)Cn2c(=O)oc(n2)c3ccccc3
|
|
|
175
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
|
176
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
|
177
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
|
178
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
|
179
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
|
180
|
Cc1cc(c(n1C)C)C(=O)COn2c3cc(ccc3nn2)Cl
|
|
|
181
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
|
182
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
|
183
|
Cc1cc([nH]c1/C=C/2C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
184
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
|
185
|
COc1cc2c(cc1OC)-c3cccn3CC2
|
|
|
186
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
|
187
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
|
188
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
189
|
Cc1c(sc(=O)n1NC(=O)Cc2ccccc2)c3ccccc3
|
|
|
190
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
|
191
|
c1cc(cnc1)c2nc3c4c(ncn3n2)CCC4
|
|
|
192
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
|
193
|
Cc1c(c(n[nH]1)n2cnc3ccccc3c2=O)c4ccccc4
|
|
|
194
|
|
|
|
195
|
Cc1nnc(s1)SCC2=NN(C(=O)C2)c3ccccc3
|
|
|
196
|
Cc1c(cnc(n1)C2CC2)c3nc(sn3)Nc4ccccc4
|
|
|
197
|
Cc1nn2cc(nc2s1)Cn3cnc4c(c3=O)cccc4OC
|
|
|
198
|
CCOc1nnc(s1)Cn2nc(nn2)c3ccccc3
|
|
|
199
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
|
200
|
c1ccc(cc1)Cn2c(c(nn2)c3[nH]c4ccccc4n3)N
|
|
|
201
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
|
202
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
|
203
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
|
204
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
|
205
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
|
206
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
|
207
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
|
208
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
|
209
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
|
210
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
|
211
|
C1CCC(CC1)S(=O)(=O)C2=CC3CCCC4C3C2CCC4
|
|
|
212
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
|
213
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
|
214
|
CSc1nnc(o1)Cn2cnc(c2Cl)Cl
|
|
|
215
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
216
|
CC(C)[C@@H]1[C@@H](N=C(O1)c2ccccc2)n3c4ccccc4nn3
|
|
|
217
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
|
218
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
|
219
|
CC(=O)N[C@@H](CS/N=N/c1ccccc1)C(=O)[O-]
|
|
|
220
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
|
221
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
|
222
|
CC(C)(C)OC(=O)N1CCC(=CC1)C#Cc2ccccn2
|
|
|
223
|
c1c2c(cc3c1OCO3)-c4c(c(=O)c4=O)CC2
|
|
|
224
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
|
225
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
|
226
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
|
227
|
Cc1ccn(n1)CC/N=C/[C@@H](C(=O)C2=O)NCCCOC
|
|
|
228
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
229
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
|
230
|
c1ccc2c(c1)C(=NS2(=O)=O)Sc3nc4ccccc4o3
|
|
|
231
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
232
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
|
233
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
|
234
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
235
|
c1ccc2c(c1)c(ncn2)N3CCNc4c3cccc4
|
|
|
236
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
|
237
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
238
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
|
239
|
c1ccc(c(c1)/C=c/c(n/c(=C/C(=O)N3CCCC3)/s2)[O-])O
|
|
|
240
|
Cc1c(c(n(n1)c2ccccc2)C)c3nc(no3)c4ccccc4
|
|
|
241
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
|
242
|
Cc1cc(n(n1)C(=O)c2c(nc(s2)Nc3ccccc3)C)C
|
|
|
243
|
CSc1nnc(s1)CN2CCSc3c2cccc3
|
|
|
244
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
|
245
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
|
246
|
C1CC[C@@H]2[C@@H](C1)NC(=O)C(=N2)CCC(=O)[O-]
|
|
|
247
|
c1ccc2c(c1)ncn2c3c(nc4nccn4n3)C(F)(F)F
|
|
|
248
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
|
249
|
|
|
|
250
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
|
251
|
c1ccc(cc1)n2c(nnn2)Sc3nc4ccccc4o3
|
|
|
252
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
|
253
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
|
254
|
c1cc2ccc3cccc4c3c2c(c1)C4
|
|
|
255
|
CC(=O)Nc1nnc(s1)[C@@H]2CC(=O)N(C2)c3ccccc3
|
|
|
256
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
|
257
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
|
258
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
|
259
|
CCC(=O)Nc1cnn(c1)Cc2nnnn2CCOC
|
|
|
260
|
|
|
|
261
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
|
262
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
|
263
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
|
264
|
CC(=O)N1CCC(CC1)c2nnc(s2)c3ccco3
|
|
|
265
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
|
266
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
|
267
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
|
268
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
|
269
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
|
270
|
Cc1c(ccnc1COc2nc3ccccc3o2)OCC(C)C
|
|
|
271
|
Cc1c(sc2c1/c(=[NH+]/Cc3cn4ccccc4n3)/nc[nH]2)C
|
|
|
272
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
|
273
|
CN(C)c1ccc(cc1)/C=C/C2=NC(=O)N[C@@H](C2)C(F)(F)F
|
|
|
274
|
CC1(CC(=O)[C@@H]2[C@H](NC3CCCCC3CC2=N1)C4CCCNC4)C
|
|
|
275
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
|
276
|
CC1=C(C(=O)NC2=NNC(=O)[C@@H]12)CCC(=O)[O-]
|
|
|
277
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
|
278
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
|
279
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
|
280
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
|
281
|
c1c2n(cn1)[C@@H](CCC2)CCCC#N
|
|
|
282
|
Cc1cc(=O)c(c(o1)Nc2nnns2)C(=O)C
|
|
|
283
|
c1cc2c(cc1CN3[C@@H]4C=CC=C[C@H]4C(=O)C3=O)OCO2
|
|
|
284
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
|
285
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
|
286
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
|
287
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
|
288
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
|
289
|
|
|
|
290
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
|
291
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
292
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
|
293
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
|
294
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
|
295
|
c1cn(c(n1)CN(Cc2nnnn2C3CC3)C4CC4)C(F)F
|
|
|
296
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
|
297
|
c1ccc(cc1)c2nnc(o2)Cn3c4ccccc4sc3=O
|
|
|
298
|
COCc1cn(nn1)[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
|
299
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
|
300
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
|
301
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
|
302
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
|
303
|
CCc1cc(c(cc1OC)O)c2c(cn[nH]2)c3nc(cs3)C
|
|
|
304
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
|
305
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
|
306
|
Cc1cc(=O)n2c(n1)sc(n2)Cn3nc(nn3)c4ccccc4
|
|
|
307
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
|
308
|
c1ccc2c(c1)C[C@@H]([C@@H]2Sc3ncccn3)O
|
|
|
309
|
c1ccnc(c1)[C@@H]2Nc3c(c4c(s3)CCCC4)C(=O)N2
|
|
|
310
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
|
311
|
Cn1c(cc(=O)n(c1=O)C)Cn2nc(nn2)c3ccccc3
|
|
|
312
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
|
313
|
c1ccc(cc1)c2ccc(cc2)c3cc(c4c(n3)ocn4)C(=O)[O-]
|
|
|
314
|
c1ccc2c(c1)[nH]c(n2)c3c(n(nn3)c4cccc(c4)F)N
|
|
|
315
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
|
316
|
|
|
|
317
|
Cc1ccc(cc1)S(=O)(=O)Nn2c3ccccc3nn2
|
|
|
318
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
|
319
|
CC1(Cc2c(n3c(c2C#N)nc(cn3)c4ccccc4)CO1)C
|
|
|
320
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
|
321
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
|
322
|
c1ccc(cc1)c2nc(on2)c3c(n(nn3)c4ccccc4)N
|
|
|
323
|
COc1ccc(cc1OC)/C=C/c2nc(on2)c3ccccc3O
|
|
|
324
|
COC1=C(C(=O)N[C@@H]1C(=O)c2ccccc2)C(=O)OC
|
|
|
325
|
CCc1cc2c(cc1O)OC=C([C@@H]2O)c3ccc4ccccc4n3
|
|
|
326
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
|
327
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
|
328
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
|
329
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
330
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
|
331
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
|
332
|
c1ccc(cc1)c2nnn(n2)Cn3c(=O)c4ccccc4nn3
|
|
|
333
|
c1ccc2c(c1)-c3ccccc3C2n4c5ccccc5nn4
|
|
|
334
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
|
335
|
CCc1n[n-]/c(=N/C(=O)c2c(c(c(c(c2F)F)F)F)F)/s1
|
|
|
336
|
CCCCCNS(=O)(=O)c1csc(n1)c2ccc(cc2)F
|
|
|
337
|
Cc1nc2cc([nH]c2c(n1)N3CCC=CC3)c4ccccc4
|
|
|
338
|
CC1=C(c2ccccc2C1)Sc3ccccc3
|
|
|
339
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
340
|
CCSc1nnc(s1)/N=C(/C2CCC2)[O-]
|
|
|
341
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
|
342
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
|
343
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
|
344
|
c1ccc2c(c1)ncn2/C=C/NC(=O)c3ccc(cc3)Cl
|
|
|
345
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
|
346
|
CC(=O)Nc1nc2ccc(cc2s1)c3nc4ccccc4o3
|
|
|
347
|
Cc1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C=C2
|
|
|
348
|
CC1CCC2C3C1C(=O)[C@@H](C3=CCN2C(=O)C)C(=O)N
|
|
|
349
|
c1ccc(cc1)n2cc(cn2)c3c4cc(ccc4on3)F
|
|
|
350
|
C1CCC(CC1)CNC(=O)/N=C/2N-3C(NS2)CC4C3CCCC4
|
|
|
351
|
c1ccnc(c1)n[nH]/c2=NC(=O)C3CC3
|
|
|
352
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
|
353
|
Cc1c(sc(n1)c2ccccc2)c3nnc(o3)C4CC4
|
|
|
354
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
|
355
|
Cc1ccc(cc1)NC(=O)c2nnc(s2)Cn3ccnc3
|
|
|
356
|
Cc1ccccc1CC(=O)N2CCCS2(=O)=O
|
|
|
357
|
Cc1c(cccn1)c2cc3cccnc3n2CCC(=O)[O-]
|
|
|
358
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
|
359
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
|
360
|
Cn1c(=O)c(nn(c1=O)C)Oc2ccc3c(c2)OCO3
|
|
|
361
|
c1ccc2c(c1)CCN(C2)Cn3c(ncn3)c4ccccc4Cl
|
|
|
362
|
Cn1c(nnn1)Sc2cccc(c2C#N)F
|
|
|
363
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
|
364
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
|
365
|
|
|
|
366
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
|
367
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
|
368
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
|
369
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
|
370
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
|
371
|
CC1(c2cc3ccccc3[o+]c2C=C4C1=Cc5ccccc5O4)C
|
|
|
372
|
Cc1c(sc(n1)CCn2cccc(c2=O)C(F)(F)F)C(=O)C
|
|
|
373
|
CCc1nnc(o1)Cn2cnc3ccccc3c2=O
|
|
|
374
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
|
375
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
|
376
|
c1ccc-2c(c1)-c3cccc4c3c2ccc4
|
|
|
377
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
|
378
|
|
|
|
379
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
|
380
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
|
381
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
|
382
|
CC(=O)N1CN(Cn2c1nc3c2cccc3)CCc4ccccc4
|
|
|
383
|
CC(C)CC(=O)N1CCN(CC1)C[C@@H]2C=N[C@@H]3[C@@H]2C=CC=C3
|
|
|
384
|
CS(=O)(=O)NCCOc1ccccc1
|
|
|
385
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
|
386
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
|
387
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
|
388
|
C[C@@H]1CC(n2c3c1cccc3oc(=O)c2=O)(C)C
|
|
|
389
|
Cc1csc(n1)[C@@H](C#N)C2=NS(=O)(=O)c3c2cccc3
|
|
|
390
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
|
391
|
|
|
|
392
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
|
393
|
C#CCCCNc1c(=O)n(cc(n1)Cl)c2ccccc2
|
|
|
394
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
|
395
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
|
396
|
Cc1c2ccccc2[nH]c(=O)c1Sc3nnnn3C
|
|
|
397
|
Cn1c2ccccc2nc1Cn3nc(nn3)c4ccccc4
|
|
|
398
|
CCn1/c(=N/C(=O)C)/sc(n1)SCc2ccccc2
|
|
|
399
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
|
400
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
|
401
|
C=CCN1[C@@H]2C=CC=C[C@@H]2C(=O)C1=O
|
|
|
402
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
|
403
|
Cc1ccc(cc1)c2ncc(o2)Sc3ccccc3
|
|
|
404
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
|
405
|
c1ccc2c(c1)nc3n2C4(CCCC4)NC(=[NH+]3)N
|
|
|
406
|
|
|
|
407
|
c1ccc2c(c1)c(=O)n(nn2)Cn3c(=O)oc(n3)c4cccs4
|
|
|
408
|
c1ccc(cc1)c2nnc(o2)Sc3nc4ccccc4s3
|
|
|
409
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
|
410
|
Cc1nc(on1)CN2CCSc3c2cccc3
|
|
|
411
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
|
412
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
|
413
|
CN1C(=O)C(C(CN1)SC2NC3CCCCC3S2)CL
|
|
|
414
|
CN1CCCc2c1n(c3ccccc3c2=O)Cc4ccccc4
|
|
|
415
|
Cc1c(sc(n1)c2ccccc2)c3nnc(n3C)SC
|
|
|
416
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=O)NC(=[NH+]2)N3CCCCC3
|
|
|
417
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
|
418
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
|
419
|
Cc1c(c(on1)C)C(=O)n2cc3c(n2)-c4cc(ccc4SC3)F
|
|
|
420
|
|
|
|
421
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
|
422
|
Cc1nc(cs1)Cn2c(=O)oc(n2)c3ccc(cc3)F
|
|
|
423
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
|
424
|
c1ccc2c(c1)[C@@H](OC2=O)NS(=O)(=O)c3ccc(cc3)Cl
|
|
|
425
|
|
|
|
426
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
427
|
c1ccc(cc1)CNc2cnccn2
|
|
|
428
|
c1ccc(cc1)c2nnnn2c3ccn(n3)c4ccccc4
|
|
|
429
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
|
430
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
|
431
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
|
432
|
Cn1c(=O)c2ccccc2c(n1)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
433
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
|
434
|
c1cc2c(c(c1)F)ncnc2n3ccnc3
|
|
|
435
|
C/C=C/[C@@H]1C=CC2CCCCC2[C@@]1(C)C3=NC(CO3)(C)C
|
|
|
436
|
c1ccc(cc1)[C@@H]2C=C(n3c(ncn3)N2)c4ccccc4
|
|
|
437
|
CCc1c(nc(c(n1)NC(CC)CC)CC)Nc2ccccn2
|
|
|
438
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
|
439
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
|
440
|
c1ccc(cc1)c2cc(c(nn2)c3ccccc3)c4ccco4
|
|
|
441
|
CC1CC2OC1CCCC/C=C/[C@@H](C2)OCOC
|
|
|
442
|
C[C@@H](c1nc2ccccc2o1)n3c4ccccc4nn3
|
|
|
443
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
|
444
|
|
|
|
445
|
c1ccc(cc1)c2c([nH]nc2c3[nH]c4ccccc4n3)c5ccco5
|
|
|
446
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
|
447
|
Cc1cc(c(c(c1)C)OS(=O)(=O)Nc2cccnc2)C
|
|
|
448
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
|
449
|
CN(Cc1nnc(s1)SC)c2ccccc2F
|
|
|
450
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
|
451
|
c1ccc(cc1)c2cc3nc(c4c(n3n2)nc(o4)c5ccccc5)N
|
|
|
452
|
Cn1c(cnc1Cn2c3ccccc3ncc2=O)Cl
|
|
|
453
|
CCOC(=O)C=NN=C/C1=N/NSC2CCC(CC2)C
|
|
|
454
|
c1ccc(cc1)C(=O)/N=c/n3c(ns2)-c4ccccc4C3
|
|
|
455
|
CC1C2C(C(C3N2N(N1)CC3)C(=O)OC)C(=O)OC
|
|
|
456
|
c1ccc(cc1)C2=NC(=O)N=C2NC(=O)Nc3ccc(cc3)Cl
|
|
|
457
|
c1cc(cnc1)c2cccs2
|
|
|
458
|
Cc1ccc(cc1)S(=O)(=O)Nn2c(c(nn2)c3ccccc3)C
|
|
|
459
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
|
460
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
|
461
|
CCNc2ccccc2S/C1=Cc3nc4ccccc4s3
|
|
|
462
|
Cc1c(oc(n1)Cn2nc(nn2)c3ccccc3)C
|
|
|
463
|
c1ccc2c(c1)CCN2CC(=O)N3[C@H]4CC[C@@H]3c5c(nns5)C4
|
|
|
464
|
CC1C(NC2C(N1)C(NNC2C3CCCCC3)C4CCCCC4)C
|
|
|
465
|
Cn1c(nnc1SCc2ccccc2)c3ccc(cc3)O
|
|
|
466
|
COCCSc1nnc(n1C2CC2)c3c[nH]c4c3cccc4
|
|
|
467
|
CC1=Nc2ccccc2Oc3c1ncc(c3)C(F)(F)F
|
|
|
468
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
|
469
|
c1ccnc(c1)c2cn(nn2)C3CCN(CC3)C(=O)C4CC4
|
|
|
470
|
CCSc1nnc(n1C)CSc2c([nH]c3c2cccc3)C
|
|
|
471
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
|
472
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
|
473
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
|
474
|
CCCCN1CCc2cccc(c2SC1)C
|
|
|
475
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
|
476
|
c1cc2c-3c(c1)CCc4n3c(cc4)CC2
|
|
|
477
|
CCC(CC)Nc1c(nc(c(n1)C)Oc2cc(ccn2)C)C
|
|
|
478
|
C[C@@H]1c2cccn2CCN1c3c4cn[nH]c4nc(n3)N
|
|
|
479
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
|
480
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
|
481
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
|
482
|
CC(C)/N=c/1ccccn1C(=O)COc2ccc(cc2)Cl
|
|
|
483
|
CC1=NC(=O)[C@@H](C=C1c2ccc3nccn3c2)C#N
|
|
|
484
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
|
485
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
|
486
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
|
487
|
c1ccc(cc1)C2=C(C=NC(=C3C=CC(=O)C=C3)N2)c4cnccn4
|
|
|
488
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
|
489
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
|
490
|
c1cc(oc1)c2nc3c(cc(cn3n2)C(=O)N4CCCC4)N
|
|
|
491
|
COC1=NS(=O)(=O)C2(O1)c3ccccc3-c4c2cccc4
|
|
|
492
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
|
493
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
|
494
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
|
495
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
|
496
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
|
497
|
C[C@@H](Cc1ccccc1)N(CC#C)C(=O)OC2=CCN(CC2)C
|
|
|
498
|
|
|
|
499
|
c1ccc(cc1)Cn2c(nnc2Cl)C3CC3
|
|
|
500
|
|
|
|
501
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
|
502
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
|
503
|
|
|
|
504
|
CCOC(=O)C1C(C2C(S1)N(C(=O)S2)C3CCCCC3)[O-]
|
|
|
505
|
Cc1c(cn(n1)CC=C)CNCc2c(nns2)C
|
|
|
506
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
|
507
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
|
508
|
C=CCN1C2CCCCC2C(C1O)C3=C4CCCCC4=NC3=O
|
|
|
509
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
|
510
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
|
511
|
c1ccc2c(c1)-c3c4c(cccc4sn3)C2=O
|
|
|
512
|
CCOC(=O)c1cnc(nc1Sc2nnc(s2)C)SC
|
|
|
513
|
CCOc1ccc(cc1C)c2nnc(n2c3ccc(nc3)OC)C
|
|
|
514
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
|
515
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
|
516
|
|
|
|
517
|
Cn1cnc2c(c1=O)noc2C(=O)c3ccccc3
|
|
|
518
|
Cc1c(sc2c1c(nnc2c3ccccc3)N4CCCC4)C#N
|
|
|
519
|
Cc1nc(nc(=O)n1c2ccccc2)Nc3ccccc3
|
|
|
520
|
CC1=C(C(=O)N(CO1)C(C)(C)C(=O)[O-])c2ccccc2F
|
|
|
521
|
Cc1ccc(cc1)c2nc(on2)c3cc4ccccc4[nH]3
|
|
|
522
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
|
523
|
CC(C)(C)OC(=O)N[C@@H](CC#Cc1ccccc1)C(=O)OC
|
|
|
524
|
Cc1ccc(nc1)C[S@@](=O)C2=NC3=CS[C@H](C3=N2)C(=O)C
|
|
|
525
|
c1ccc(cc1)n2c(nnn2)Cn3c(nnn3)C4CCCC4
|
|
|
526
|
Cc1c(c(n(n1)C)Sc2ccccn2)N
|
|
|
527
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
|
528
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
|
529
|
COC1CC2C3C(C1)SCC(=O)N3NN2
|
|
|
530
|
C[C@@H]1Cn2c(cc3c2c(ccc3)O1)C(=O)[O-]
|
|
|
531
|
CC(=C)[C@@H](C(=O)OC)N1C(=O)C(CS1)NCC2CCCCC2
|
|
|
532
|
Cc1c(c2c(o1)c(c(c(c2F)F)F)F)c3nc(on3)C(C)(C)C
|
|
|
533
|
[H]/N=c/n(cc(s1)c2ccccc2)c3ccccc3C
|
|
|
534
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
|
535
|
C1CCC(CC1)C2=NCC=CC3C2CCCC3
|
|
|
536
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
|
537
|
c1c2c(cc3c1OCO3)nnn(c2=O)CCC4=CCC(=O)CC4
|
|
|
538
|
c1ccc2c(c1)ccc3c2c4c(o3)cno4
|
|
|
539
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
|
540
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
|
541
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
|
542
|
c1cc(cnc1)C#CCCN2CCC(=CC2)c3cccs3
|
|
|
543
|
CO[C@@H]1c2cccc3c2c(ccc3)[C@@H]1NS(=O)(=O)C
|
|
|
544
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
|
545
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
|
546
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
|
547
|
C[C@@H](c1ccccc1)Nc2cc3c(cn2)onc3c4ccccc4
|
|
|
548
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
|
549
|
C1CCC(CC1)C2NOC(=O)N2CC3CN4CCSC4N3
|
|
|
550
|
c1cc(ccc1Cn2c(=O)oc(n2)c3ccoc3)C#N
|
|
|
551
|
c1ccc2c(c1)c(sn2)N3CCCCCC3
|
|
|
552
|
CC1C(N2C(NCN2)NN1)N(C)C3CCCCC3
|
|
|
553
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
|
554
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
|
555
|
CCOC(=O)/C=C(/c1cnc2n1cccc2)C(F)(F)F
|
|
|
556
|
C[C@@H]1c2ccsc2CCN1Cn3c4ccccc4oc3=O
|
|
|
557
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
|
558
|
CC(=O)[C@@H]1C2=c3c(cccc3=[NH+]C1=O)C(=O)c4c2cccc4
|
|
|
559
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
|
560
|
Cc1c2c(n[nH]1)C=C(C[C@@H]2c3ccco3)c4ccco4
|
|
|
561
|
Cc1ccc(n1c2c3c(cccc3F)n(n2)S(=O)(=O)C)C
|
|
|
562
|
|
|
|
563
|
c1ccn2c(c1)nn(c2=O)CCn3c(noc3=O)c4cccs4
|
|
|
564
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
|
565
|
C[S@@](=NCn1c2ccccc2nn1)(=O)c3ccccc3
|
|
|
566
|
C=Cc1c(c(c2n1cccc2)c3c4ccccc4c(=O)[nH]n3)N
|
|
|
567
|
CCCNC(=O)Nc1c(c(c(o1)C)C)C#N
|
|
|
568
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
|
569
|
Cc1c(c(n[nH]1)O)[C@@H]2c3ccccc3C(=O)O2
|
|