(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
|
2
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
|
3
|
Cc1c-2nc(c(=O)cc2n(n1C)c3ccccc3)c4ccccc4
|
|
|
4
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
|
5
|
CC(=CC[C@@H]1[C@@H](CCC1=O)c2cc(on2)Cc3ccccc3)C
|
|
|
6
|
|
|
|
7
|
CCOC(=O)C1=C(CN(C1)Cc2ccccc2)c3ccccc3
|
|
|
8
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
|
9
|
COC1CC2C(CC1OC)-C3C(OC(=O)N3CC2)C4CCCCC4
|
|
|
10
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
|
11
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
|
12
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
13
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
|
14
|
c1ccc(cc1)c2cc(=O)on2c3ccccc3
|
|
|
15
|
c1ccnc(c1)c2c(c3n(n2)CCC3)c4ccc(cc4)F
|
|
|
16
|
CC1(C=C(c2cc(ccc2C1=O)F)n3ccccc3=O)C
|
|
|
17
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
|
18
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
|
19
|
c1ccc(cc1)Oc2ccccc2c3cc4c(nc3)nn[nH]4
|
|
|
20
|
c1ccc2c(c1)C(=NC(=O)c3ccccc3N2)c4cccc(c4)O
|
|
|
21
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
22
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
|
23
|
c1ccc(cc1)c2ccn3c(c2)ncc3c4cnsc4
|
|
|
24
|
Cn1c(cc(c1c2ccsc2)c3ccsc3)c4cccs4
|
|
|
25
|
Cc1c2c(n(n1)c3ccccc3)-c4ccccc4NC(=O)C2
|
|
|
26
|
c1ccc(cc1)NC(=O)N(c2ccccc2)C3=NCCC3
|
|
|
27
|
CCOC(=O)Cn1c(c(nn1)C(=O)c2ccco2)c3ccccc3
|
|
|
28
|
C1CCC(CC1)[C@@H]2CC/C(=C/3C=CC(=N3)C4CCCCC4)/[NH2+]2
|
|
|
29
|
Cc1c2c(n(n1)c3ccccc3)-c4ccccc4S2(=O)=O
|
|
|
30
|
Cc1c(c(n(n1)c2ccccc2)Cn3c4ccccc4oc3=O)C#N
|
|
|
31
|
C=CCSc1cc(cc(c1C#N)c2ccccc2)C3CC3
|
|
|
32
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
|
33
|
C=CCc1nc(c2n1cccc2)N3CCOC3=O
|
|
|
34
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
|
35
|
Cc1ccc(cc1)C(=O)Nc2cc(c(n(c2=O)N)C)c3cc[nH]n3
|
|
|
36
|
c1cc(sc1)c2c(nc([nH]2)[C@@H]3CCC=CC3)c4cccs4
|
|
|
37
|
CN1C=C[C@@H]2c3ccccc3[C@@H](C2=C1)c4ccccc4
|
|
|
38
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
|
39
|
c1cc2cn[nH]c2cc1C3=CCOCC3
|
|
|
40
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
|
41
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
|
42
|
c1cc(ccc1c2c(nn3c2OCCC3)c4ccncc4)F
|
|
|
43
|
Cc1c2c([nH]n1)C(=O)N([C@H]2c3ccccc3)c4ccccn4
|
|
|
44
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
|
45
|
c1ccc(cc1)c2nc(=[NH2+])sn2c3ccccc3
|
|
|
46
|
c1cnc(nc1)N2CCC[C@H]2c3nc(no3)c4cncnc4N
|
|
|
47
|
c1ccc(cc1)c2c3ccccn3nc2C(=O)c4ccccc4O
|
|
|
48
|
C=CCSc1nc2c(c(n1)c3cccs3)CCCC2
|
|
|
49
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
|
50
|
C1CCC(CC1)N2C3CCCCC3S(=O)(=O)N4C2=NCC4
|
|
|
51
|
Cc1cccc(c1)/N=C/2CNC(=NC2=O)[O-]
|
|
|
52
|
Cncc([nH]/c1=NC(=O)C23CC4CC(C2)CC(C4)C3)[O-]
|
|
|
53
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
|
54
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
|
55
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
|
56
|
CCc1nc(n(c(=O)n1)c2ccccc2)N3CCOCC3
|
|
|
57
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
|
58
|
Cn1c(c(c(=O)n1C)c2ccccn2)c3ccc4c(c3)nccn4
|
|
|
59
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
|
60
|
c1cc(oc1c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4)[C@@H]5CCCCO5
|
|
|
61
|
c1ccc2c(c1)nc(c3n2ccc3)n4cccc4
|
|
|
62
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
63
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
|
64
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
|
65
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
|
66
|
c1ccc(cc1)Nc2c(nnn2c3ccccc3)c4ccn[nH]4
|
|
|
67
|
c1cc2c(c(c(o2)c3ccncc3)c4ccc(cc4)F)nc1
|
|
|
68
|
c1ccc(cc1)c2c(nc(c(=O)n2c3ccccc3)C#N)Cl
|
|
|
69
|
Cc1cc-2n(n1)[C@@H](Nc3c2cccc3)c4cccnc4
|
|
|
70
|
Cc1c(c2c(c(c1O)C)C[C@@H](O2)CCn3ccc(=O)c(c3C)O)C
|
|
|
71
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
|
72
|
c1ccc(cc1)Sc2c3[nH]ncn3c(=O)nn2
|
|
|
73
|
c1ccc(cc1)C2=CC(NC=N2)(c3ccccc3)c4ccccc4
|
|
|
74
|
c1ccc(cc1)NC2=Nc3ccccc3CCC2
|
|
|
75
|
c1ccc2c(c1)nn(n2)[C@@H](c3ccco3)C(=O)c4cccs4
|
|
|
76
|
CC1=C([C@@H](C2=CNNC2=N1)c3ccccc3)C(=O)OC
|
|
|
77
|
Cn1cc(c(n1)c2ccncc2)c3ccc4c(c3)C(=O)NC4
|
|
|
78
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
|
79
|
c1ccc(cc1)[C@@H]2CC(=O)[C@@H](c3n2c4ccccc4n3)C#N
|
|
|
80
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
|
81
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
|
82
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
83
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
|
84
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
|
85
|
Cc1cn(c(n1)c2cccnc2)c3ccc(cc3)S(=O)(=O)C
|
|
|
86
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
|
87
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
|
88
|
Cc1ccc(cc1)N(CC2=NCNC2)c3cccc(c3)O
|
|
|
89
|
CNC1=Nc2ccc(cc2C(=NC1)c3ccccc3F)Cl
|
|
|
90
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
|
91
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
|
92
|
c1ccc(cc1)C2=CC(=O)N3CCN=C3N2c4ccccc4N
|
|
|
93
|
Cc1[nH]c(c(n1)[C@@H](c2ccc(cc2)F)C(C#N)C#N)[O-]
|
|
|
94
|
CSc1nnc(n1c2ccccc2)N3CCCCC3
|
|
|
95
|
c1ccc(cc1)CSC2=Nc3ccc(cc3C(=O)[C@H]2C#N)F
|
|
|
96
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
|
97
|
[H]/N=c/n(cc(s1)c2ccccc2)c3ccccc3C
|
|
|
98
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
|
99
|
c1ccc(cc1)c2c(oc(=O)o2)c3ccccc3
|
|
|
100
|
c1ccc(cc1)[C@@](CC#CN2CCCCC2)(C3CCCC3)O
|
|
|
101
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
|
102
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
|
103
|
COCCN1[C@@H]([C@@H](C1=O)Sc2ccccc2)c3cccs3
|
|
|
104
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
|
105
|
|
|
|
106
|
c1cc(ccc1C2=C/C(=C/3C=C(C=CC3=O)Cl)/ON2)F
|
|
|
107
|
c1ccc(cc1)/N=c/n(c(cs2)O)c3ccccc3
|
|
|
108
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
|
109
|
Cc1c(nccn1)c2ccn[nH]2
|
|
|
110
|
c1ccc(cc1)c2c3ccoc3cnc2n4c5ccccc5nn4
|
|
|
111
|
Cc1c(cnn1c2ccccc2)c3ccnn3C(=O)c4ccco4
|
|
|
112
|
CN1C(=O)C2C([NH]C1=O)S(=O)(=O)C3CCCCC3C2
|
|
|
113
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
|
114
|
CCOC(=O)C1=C2[C@@H](c3ccccc3OC2=O)N(C(=O)C1)C
|
|
|
115
|
c1ccc(cc1)C2=CC(=O)O[C@@]23CCCC=C3
|
|
|
116
|
c1ccc2c(c1)-c3c(nc4ccccc4n3)C5=NNNN25
|
|
|
117
|
c1ccc(cc1)C2=C(OCCO2)c3ccccc3
|
|
|
118
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
|
119
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
|
120
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
|
121
|
c1cc(sc1)c2nn(c(=O)n2c3ccncc3)CCC#N
|
|
|
122
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
|
123
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
|
124
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
|
125
|
c1ccc(c(c1)[C@@H]2c3ccsc3[C@@H]4CCCC[C@@H]4O2)N
|
|
|
126
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
|
127
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
|
128
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
|
129
|
c1ccc2c(c1)nc3n2[C@@H](NC(=[NH+]3)N)c4ccco4
|
|
|
130
|
Cn1c(c(c(=O)[nH]c1=O)Oc2ccc(cc2Cl)F)N
|
|
|
131
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
|
132
|
c1ccc(cc1)Oc2c(c3ccccc3[nH]2)c4ccco4
|
|
|
133
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
|
134
|
c1ccc(cc1)[C@@]2([C@@H](Sc3n2c4c(n3)CCC4)CC(=O)[O-])O
|
|
|
135
|
c1ccc(c(c1)N)Nc2c(cn(c(=O)n2)Cc3cccs3)C#N
|
|
|
136
|
CCOC(=O)c1c2cccc3c2n(c1c4ccccc4)CCS3
|
|
|
137
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
|
138
|
Cc1nc2c(c(n1)N3CCCC3)CN(CC2)C(=O)C
|
|
|
139
|
c1cc2c(c(c1)F)ncnc2n3ccnc3
|
|
|
140
|
c1ccc2c(c1)[C@@H]3c4c([nH]c(=O)s4)SC=C3CO2
|
|
|
141
|
c1ccc2c(c1)CCCN2c3c(cno3)C#N
|
|
|
142
|
CC1(C=C(c2ccccc2O1)n3ccccc3=O)C
|
|
|
143
|
C1CCC(CC1)N2C3CCCCC3S(=O)(=O)N4C2NCC4
|
|
|
144
|
CC(=O)n1cc(c(n1)c2ccc(cc2)Cl)n3ccccc3=O
|
|
|
145
|
CN1CC(=C(C1=O)O)c2ccc(cn2)Cc3ccc(cc3)F
|
|
|
146
|
CCN1CC(=O)N=C1NCCc2cccc(c2)Cl
|
|
|
147
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
|
148
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
|
149
|
c1ccc(cc1)/C/2=N/c3ccccc3NC(=O)c4c2cccc4
|
|
|
150
|
CCOC(=O)[C@@H]1[C@@H](N=C(N=C1C)O)/C=C/c2ccccc2
|
|
|
151
|
COC(=O)[C@@]12CC3CCCCC3[C@@H]([C@@H]1C4C2CCCC4)O
|
|
|
152
|
CCc1nc(c2n1c(ccc2)C)N3CCCC3=O
|
|
|
153
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
|
154
|
c1ccc(cc1)CS(=O)(=O)n2cnc3c2[nH]c(=O)[nH]c3=O
|
|
|
155
|
CCn1c(c(c2c1nc3ccccc3n2)c4[nH]c5ccccc5n4)N
|
|
|
156
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
|
157
|
CNC(=O)c1c2c(ccs2)nc(n1)NCc3cccnc3
|
|
|
158
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
|
159
|
CSc1nc(cc(n1)n2cnc3c2cccc3)c4ccccc4
|
|
|
160
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
|
161
|
CCn1/c(=N/C(=O)C)/sc(n1)SCc2ccccc2
|
|
|
162
|
Cc1c(c(n[nH]1)O)[C@@H](c2ccco2)C(C#N)C#N
|
|
|
163
|
c1ccc(cc1)c2cc3n(c2)c4ccccc4n3N
|
|
|
164
|
c1ccc(cc1)c2cc(nc3c2c4c(o3)oc(n4)N)c5ccccc5
|
|
|
165
|
c1ccc(cc1)c2c([nH]nc2c3[nH]c4ccccc4n3)c5ccco5
|
|
|
166
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
|
167
|
COC1CCC(CC1)/C=C/2C(=C)[NH]N(C2=O)CC3CCCCC3
|
|
|
168
|
C1CCC(CC1)C[S@@](=O)C2CCCCC2CN3CCCC3
|
|
|
169
|
C=CCNC(=O)Cn1c(cc2c1nccc2)[C@@H]3CCCO3
|
|
|
170
|
Cc1cc(=O)oc2c1c(=O)[nH]nc2c3ccccc3
|
|
|
171
|
|
|
|
172
|
Cc1c(sc(n1)c2c(cnc(n2)NCC=C)c3ccsc3)C
|
|
|
173
|
c1cc(ccc1c2c(ocn2)c3ccc4nncn4c3)F
|
|
|
174
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
|
175
|
c1ccc(cc1)C2=NC(=O)N=C2NC(=O)Nc3ccc(cc3)Cl
|
|
|
176
|
CC(=O)N[C@@H]1CCC2CCCCC2-C3C1CC(=O)CCC3
|
|
|
177
|
c1cc(cnc1)C2=NC(=O)C3(N2)CCCC3
|
|
|
178
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
|
179
|
Cc1ccc(cc1)SCCN(C)Cc2cnc(nc2)OC
|
|
|
180
|
COc1ccccc1n2c(coc2=O)c3ccc(cc3)F
|
|
|
181
|
C1CCC(CC1)C2NCC3N2NCN3C4CCCCC4
|
|
|
182
|
|
|
|
183
|
CCCN(CCC)c1cc(nc2c1nn(c2c3ccccc3)C)C
|
|
|
184
|
Cn1c(nnc1Sc2cnccn2)c3ccc(cc3)F
|
|
|
185
|
Cc1cc([nH]c1/C=C/C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
186
|
c1ccc(cc1)n2c3c(nc2Cl)CCC3
|
|
|
187
|
c1ccc2c(c1)CCc3ccccc3NC2
|
|
|
188
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
|
189
|
CCOC1=N[C@@]2([C@@]1(SC3C2CCCC3)C)C4CCCCC4
|
|
|
190
|
C[C@@H]1CC2=C([C@@H](Sc3ccccc3N2)c4ccccc4)C(=O)C1
|
|
|
191
|
Cc1nc2cc(ccc2s1)/[NH+]=c/ccc4ccccc4n3C
|
|
|
192
|
c1ccc(cc1)C[C@@H]2CCOC(=O)N2
|
|
|
193
|
c1csc2c1c(=O)oc(=O)[nH]2
|
|
|
194
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
|
195
|
c1cc(ccc1C2=C(N=CC2)c3ccncc3)F
|
|
|
196
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
|
197
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
|
198
|
CCNc2ccccc2S/C1=Cc3nc4ccccc4s3
|
|
|
199
|
|
|
|
200
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
|
201
|
c1ccc(cc1)/C(=C/c2cccnc2)/N3CCCCC3
|
|
|
202
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
|
203
|
c1ccc2c(c1)Cc3ccccc3NC2
|
|
|
204
|
C[C@@H](c1ccccc1)Nc2cc3c(cn2)onc3c4ccccc4
|
|
|
205
|
Cc1[nH]cc([nH+]1)S(=O)(=O)[N-]c2cc(nn2C)c3ccccc3
|
|
|
206
|
C=Cn1ccnc1CCOC(=O)c2ccc(cc2)Cl
|
|
|
207
|
C1CCC(CC1)C2(C3C(CCS3)C(=O)O2)C4CCCCC4
|
|
|
208
|
c1ccc-2c(c1)CC(=O)Cc3c2cccc3
|
|
|
209
|
CNC(=O)N(c1ccccc1)C2=NCCCCC2
|
|
|
210
|
CCn1cncc1c2nnc3n2cccc3Cl
|
|
|
211
|
c1ccc(cc1)C2=NC(=O)CC(=O)N2
|
|
|
212
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
|
213
|
C[C@@H](c1cccc(c1)F)Oc2cccc3n2c(nn3)c4c[nH]cn4
|
|
|
214
|
c1ccc(cc1)c2cc(cc([o+]2)c3ccccc3)c4ccc(cc4)O
|
|
|
215
|
c1ccc2c(c1)C3c4ccccc4C2O3
|
|
|
216
|
C1CCC(CC1)C2C3C4C(CCCN4C(=O)N2)CCC3
|
|
|
217
|
CC1C2C(N(N1)C3CCCCC3)[C@@H](NC2=O)CC4CCCCC4
|
|
|
218
|
C1CCCC(C1)C(=C/C2=C/C3CCNCC3)[C@@H](C4CCNCC4)O
|
|
|
219
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
|
220
|
c1cc(ccc1C2=C(CCC2)c3ccncc3)F
|
|
|
221
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
|
222
|
c1ccc2c(c1)NC3=C([C@@H](S2)c4ccc(cc4)F)C(=O)OC3
|
|
|
223
|
Cc1c(sc(n1)CCn2cccc(c2=O)C(F)(F)F)C(=O)C
|
|
|
224
|
CCOc1ccc2c(nc(nc2c1)/N=C/NCCC(=N3)[O-])C
|
|
|
225
|
CCOc1c2c(cc([nH]2)C(=O)OCC)nc(n1)OCC
|
|
|
226
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
|
227
|
Cc1c(cnc(n1)C2CC2)c3nc(sn3)Nc4ccccc4
|
|
|
228
|
CC1=NNC2=Nc3ccccc3[C@@H](N12)c4ccccc4
|
|
|
229
|
[H]/N=c/n(c2c(s1)CCCC2)CC(=O)c3ccccc3
|
|
|
230
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
|
231
|
CCc1nc2ccsc2c(n1)c3ccccn3
|
|
|
232
|
C1CCC(CC1)C2NOC(=O)N2CC3CN4CCSC4N3
|
|
|
233
|
c1ccc(cc1)c2c(c(sc2SCC#N)C#N)N
|
|
|
234
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
|
235
|
C1CCC(CC1)[S@@]2(=NC3C(CCCC3O)C=C2)=O
|
|
|
236
|
c1ccc2c(c1)-c3c(cn[nH]3)CC(=O)N2
|
|
|
237
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
|
238
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
|
239
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
|
240
|
c1ccc2c(c1)CCC3=C(CC2=O)C(=O)OC3
|
|
|
241
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
|
242
|
Cc1nc2cnccc2n1c3ccc(cc3)C4=CC(=O)NCCN4
|
|
|
243
|
COC1CCCC2C1OC(=C(C2)C(=O)N)NC3CCCCC3
|
|
|
244
|
CCc1cc2c(cc1O)OC=C([C@@H]2O)c3ccc4ccccc4n3
|
|
|
245
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
|
246
|
Cc1ccc2c(c1)C[C@@H]3[C@@H](N2)C(=CN(C3=O)C)CO
|
|
|
247
|
C1CCC(CC1)C2C(N3N(C2=O)[C@@H]4C[C@H]3C=C4)C5CCCCC5
|
|
|
248
|
c1ccc(cc1)c2cc3c(nc2)CCc4c(cccc4C#N)C3
|
|
|
249
|
c1ccc(cc1)c2c(=O)c3c(n4c2OCC4)CCC3
|
|
|
250
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
|
251
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
|
252
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
|
253
|
CN(C)C1=NC(=N[S@@](=N1)N(C)C)c2ccccc2
|
|
|
254
|
c1ccc(cc1)c2cc(c(nn2)c3ccccc3)c4ccco4
|
|
|
255
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
|
256
|
c1ccc(cc1)NC2=NN/C(=Nc3ccccc3)/[C@H]2Cl
|
|
|
257
|
COc1ccc(cc1OC)[C@@H]2CC[C@@H](O2)Cc3cccnc3
|
|
|
258
|
CC1CC(NN2C1C(NC2SC)C3CCCCC3)C
|
|
|
259
|
CCN(CC)c1ccc2cc3c([o+]c2c1)CCCCC3
|
|
|
260
|
COc1ccccc1c2ncc(s2)c3nnc4n3cccc4
|
|
|
261
|
C1CCC2C(C1)-C3CCCC4C3[C@@H]2OC4=O
|
|
|
262
|
c1ccc(c(c1)[C@H]2[C@@H](CCC(=O)N2)NCC3=COCCO3)F
|
|
|
263
|
Cc1cc(c(n1c2ccc(cc2)OC)C)C(=O)n3ccnc3
|
|
|
264
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
|
265
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
|
266
|
Cc1c(cno1)c2cn3ccccc3n2
|
|
|
267
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
|
268
|
CC(C)/N=c/1ccccn1C(=O)COc2ccc(cc2)Cl
|
|
|
269
|
CC(=C/C=C/c1c(c2ccccc2s1)OC(=O)N(C)C)C
|
|
|
270
|
CC1=C[C@@]2([C@@H](N=C1)N(C(=O)O2)C3CCCCC3)C
|
|
|
271
|
Cc1c(cccn1)c2cc3cccnc3n2CCC(=O)[O-]
|
|
|
272
|
CC(=O)N1C=Cc2ccccc2[C@@H]1c3c[nH]c4c3cccc4
|
|
|
273
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
|
274
|
c1c(nc2n1CCS2)CNC(=O)[C@@H]3CC(=O)OC34CCCC4
|
|
|
275
|
c1ccc(c(c1)C2=NCCC(=O)c3c2cc(cc3)Cl)F
|
|
|
276
|
c1ccn(c1)c2c(c(c(o2)c3cccs3)C#N)c4cccs4
|
|
|
277
|
CCN(CC)C1=Nc2ccccc2-n3ccnc3C1
|
|
|
278
|
c1ccc(cc1)c2c(c3ccc(nc3[nH]2)C(=O)[O-])C4CCCCC4
|
|
|
279
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
|
280
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
|
281
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
|
282
|
CCOc1ccc2c(c1)cc(c3n2c(=O)n(n3)C)C4OCCO4
|
|
|
283
|
CCOC(=O)c1c(cn2c1SCC2=O)c3ccc(cc3)F
|
|
|
284
|
c1ccc2c(c1)NC3(S2)NC(=O)C(=O)C(=O)N3
|
|
|
285
|
c1cc(sc1)c2c(c(oc2c3cccs3)N)C#N
|
|
|
286
|
c1ccc(cc1)C2=C3[C@@H](CCC2)C(=O)C(=O)O3
|
|
|
287
|
c1ccc2c(c1)[nH]c(n2)c3c(n(nn3)c4cccc(c4)F)N
|
|
|
288
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
|
289
|
Cc1c2c(n[nH]1)C=C(C[C@@H]2c3ccco3)c4ccco4
|
|
|
290
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
|
291
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
292
|
COc1cc(c(n1c2ccccc2)Oc3ccccc3)C#N
|
|
|
293
|
c1csc2c1cc([nH]2)C(=O)[O-]
|
|
|
294
|
Cn1c(=O)n2c(c(n2c1=O)c3ccccc3)c4ccccc4
|
|
|
295
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
|
296
|
CCOC(=O)c1c(c([nH]c1C)c2cn3ccccc3n2)C
|
|
|
297
|
|
|
|
298
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
|
299
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
|
300
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
|
301
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
|
302
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
|
303
|
C1CCC(CC1)C2=NCC=CC3C2CCCC3
|
|
|
304
|
C[C@@H]1N([C@@H]2c3cccc4c3c(ccc4)[C@@H]2O1)c5ccccc5
|
|
|
305
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
|
306
|
C/C=C/1C(=O)[NH]/C(=C/C2CCCCC2)/C(=O)[NH]1
|
|
|
307
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
|
308
|
CSc1nc2c(c(n1)NCCCO)SCCC2
|
|
|
309
|
C[C@@H]1Cc2ccccc2N1c3c(c(=O)c3=O)c4ccccc4
|
|
|
310
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
|
311
|
C[C@@H]1CCCC[C@@H]1NC(=O)COc2cnc(nc2)c3ccccc3
|
|
|
312
|
C=CCSc1nccn1c2ccccc2
|
|
|
313
|
CNc1ccccc1[C@@H]2C=CC(=C2)c3ccccc3
|
|
|
314
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
|
315
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
|
316
|
COc1ccc(cc1OC)/C=C/c2nc(on2)c3ccccc3O
|
|
|
317
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
|
318
|
c1cc(oc1)c2cc(sc2)Nc3ccc(cc3)S(=O)(=O)N
|
|
|
319
|
Cc1ccc(n1c2ccc3c(c2)nns3)C
|
|
|
320
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
|
321
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
|
322
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
|
323
|
Cc1c2c(nc3ccccc3n2)n(n1)c4nccs4
|
|
|
324
|
c1ccc2c(c1)cc(c(=O)o2)C3=Nc4ccccc4S(=O)(=O)N3
|
|
|
325
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
|
326
|
c1ccc(cc1)C2=C(NC(=O)CC2)c3ccccc3
|
|
|
327
|
|
|
|
328
|
CC(C)(C)[C@@]1(NC(=O)N2C=CC=CC2=N1)c3ccccc3
|
|
|
329
|
Cc1c(nc(nc1N2CCC=CC2)C3CC3)NC4CC4
|
|
|
330
|
COC(=O)N1C2CCCCC2C(=N[C@@H]1C#N)C3CCCCC3
|
|
|
331
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
|
332
|
CC1(COC(=N1)CN(Cc2ccccc2)Cc3ccccc3)C
|
|
|
333
|
c1ccc(cc1)N2C3=CCCC[C@H]3C(=O)C2=O
|
|
|
334
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
|
335
|
Cn1c(=O)c2c(c(n[nH]2)c3ccccc3)[nH]c1=O
|
|
|
336
|
Cc1c(c2c(o1)[C@@H]3CCCC[C@@H]3OC2=O)c4ccccc4
|
|
|
337
|
C1CCC(CC1)C2(CN3CCOC3=N2)C4CCCCC4
|
|
|
338
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
|
339
|
c1ccc(cc1)n2cccc2c3ccsc3
|
|
|
340
|
Cc1nc2c(n1C)CCN(C2)C[C@@H](c3ccc(cc3)OC)O
|
|
|
341
|
Cc1cs/c(=NC)/n1NC(=O)Nc2ccc(cc2)Cl
|
|
|
342
|
CC1=C(C[C@@]2(C(=C(C1)C(=O)OC)CCC2=O)C)C
|
|
|
343
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
|
344
|
Cc1c(nc2n1-c3ccccc3C2)c4ccc(cc4)OC
|
|
|
345
|
COc1ccc(cc1)/N=C/Cc2nc(c(s2)C#N)C(F)(F)F
|
|
|
346
|
CN(C)C1NC(=O)C(C(O1)C2CCCCC2)C3CCCCC3
|
|
|
347
|
c1ccc(cc1)[C@@H]2C=C(N3C(=N2)N=NN3)c4ccccc4
|
|
|
348
|
c1ccc(cc1)C2=CC(=N[C@@]2(c3ccccc3)O)c4ccccc4
|
|
|
349
|
[H]/N=c/n(nc(s1)c2cccs2)CC(=O)c3cccs3
|
|
|
350
|
c1ccc(cc1)C2(NCCCO2)c3ccccc3
|
|
|
351
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
|
352
|
Cc1ccc(cc1)/N=C/c3cccc(c3NC2=O)C
|
|
|
353
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
|
354
|
c1ccc(cc1)C2=CC=C(C2)c3ccccc3
|
|
|
355
|
c1ccc(cc1)N(CCC#N)c2c(c3ccccc3s2)Cl
|
|
|
356
|
Cc1c(c(c2n1Cc3ccccc3C2)C(=O)OC)C(=O)OC
|
|
|
357
|
Cc1c(c2n(n1)C(CC(=N2)C)(C)C)c3ccccc3
|
|
|
358
|
c1ccc(cc1)c2ncnn2c3c(c4c(s3)CCCC4)C#N
|
|
|
359
|
COC(=O)[C@@H](Cc1cncn1Cc2cc(cc(c2)Cl)Cl)N
|
|
|
360
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
|
361
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
|
362
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
|
363
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
|
364
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
|
365
|
c1c(cnc2c1COC(=O)N2)Br
|
|
|
366
|
c1ccc(cc1)[C@@H]2NC(=[NH+]C(=N2)c3ccccc3)c4ccccc4
|
|
|
367
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
|
368
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
|
369
|
CN(C)c1nc(nc(n1)OC)n2cc(nn2)c3ccccc3
|
|
|
370
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
371
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
|
372
|
c1ccc(cc1)[C@@H]2C=C(n3c(ncn3)N2)c4ccccc4
|
|
|
373
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
|
374
|
c1ccc(cc1)S(=NC(=O)c2ccco2)c3ccccc3
|
|
|
375
|
CC1(C(=N[C@@H](C(=O)N1)c2ccccc2)c3ccccc3)C
|
|
|
376
|
CC(=O)Nc1ccc(cc1)C2=NC3=Cc4ccccc4O[C@@H]3O2
|
|
|
377
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
|
378
|
CSc1nc(c(n1Cc2ccco2)C#N)N
|
|
|
379
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
|
380
|
CC(C)/C=C/C1=CC2=C(C1)Cc3c2cccc3
|
|
|
381
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
|
382
|
Cc1ccccc1CN[C@@H]2COC[C@H]2c3ccc(cc3)F
|
|
|
383
|
CC(=O)c1c(n(nn1)C2CCCCC2)NC3CCCCC3
|
|
|
384
|
Cc1ccc(s1)[C@@H]2CCCc3c2cccc3
|
|
|
385
|
c1ccc2c(c1)[C@@H](OC2=O)NS(=O)(=O)c3ccc(cc3)Cl
|
|
|
386
|
C[C@@H](Cc1ccccc1)N(CC#C)C(=O)OC2=CCN(CC2)C
|
|
|
387
|
C[C@@H]1Cc2c(cc(n2C)c3nnc(n3c4ccccc4)SC)O1
|
|
|
388
|
c1csc2c1c(ncn2)n3ccnc3
|
|
|
389
|
CCc1c(nn2c1N/C(=C/3C=C([NH+]=N3)C4CC4)/C=C2O)C
|
|
|
390
|
c1ccc(cc1)n2c(nnc2[O-])c3cccnc3
|
|
|
391
|
c1ccc(cc1)c2c3c(csc3nnc2c4ccccc4)O
|
|
|
392
|
CSc1ccc(cc1)c2nc(on2)c3ccc[nH]c3=O
|
|
|
393
|
CC(C)(C)OC(=O)N1CCC=C(C1)c2coc3ccccc3c2=O
|
|
|
394
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
|
395
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
|
396
|
c1cc2c(c(c1)F)N3CCC[C@@H]3[C@@]4(C2)C(=O)COC4=O
|
|
|
397
|
COc1ccc(cc1)n2c3ccccc3nc2Cn4cnc(n4)C#N
|
|
|
398
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
|
399
|
c1ccc(cc1)[C@@]2(C=C(C(=O)N2c3ccccc3)O)O
|
|
|
400
|
C1CCC(CC1)C2=CC(=C(C2)C(=O)[O-])C3CCCCC3
|
|
|
401
|
CCc1c2c(n(n1)C3CCCC3)C(=O)N(CC2)c4ccccc4
|
|
|
402
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
|
403
|
CN(C)C(=O)n1c(nnn1)Cc2ccc(cc2)c3ccccc3
|
|
|
404
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
|
405
|
c1ccc(cc1)n2c(noc2=O)c3cccnc3
|
|
|
406
|
C1CCC2C(C1)[C@@H]3C4CCNCC4[C@H]2O3
|
|
|
407
|
c1ccc(cc1)SC2=C(CC2)Sc3ccccc3
|
|
|
408
|
C[C@@H]1[C@@H]2[C@@H](C=C3CCCC[C@H]3[C@@H]2/C=C/c4ccccn4)C(=O)O1
|
|
|
409
|
COc1ccc(cc1)[C@@H]2C(=NC(=O)N2)c3ccc(cc3)OC
|
|
|
410
|
c1ccc2c(c1)-c3nc4ccccc4n3[C@H](N2)c5ccco5
|
|
|
411
|
Cc1ccc2c(c1)c(c(c(n2)SC)n3cccc3)C
|
|
|
412
|
c1ccc(cc1)NC(=O)[C@@H]2Cc3c2cccc3
|
|
|
413
|
CC(=O)N[C@@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
|
414
|
c1ccc(cc1)CC2=C(C=NC(=O)C2)C(=O)N
|
|
|
415
|
c1ccc2c(c1)ccn2Cc3nnc(s3)Cc4cccs4
|
|
|
416
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
|
417
|
COC(=O)C1=Nn2c3ccccc3nc2CC1
|
|
|
418
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
|
419
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
|
420
|
CCN1c2ccccc2N[C@@H]3[C@@H]1OC(=C3C(=O)OCC)C
|
|
|
421
|
[H]/N=C/NC(=C2[C@@H]([C@@H](C(=O)N=C2N1)C#N)c3ccccc3)[O-]
|
|
|
422
|
c1ccc(cc1)[C@@]2(NC(=O)N3CCN=C3O2)C(F)(F)F
|
|
|
423
|
c1ccc2c(c1)CCC(=C2)c3cccnc3
|
|
|
424
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
|
425
|
c1ccc(c(c1)C(=O)[C@@H]2C(=NN=N2)C(F)(F)F)O
|
|
|
426
|
Cc1c2c(c3ccccc3o2)c4c(n1)CC(CC(=O)N4)(C)C
|
|
|
427
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
|
428
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
|
429
|
c1cc(sc1)c2cc(c(nc2c3nccs3)[O-])C#N
|
|
|
430
|
|
|
|
431
|
CC1(CC2(C3=C(O1)C(=O)OC3)Nc4ccccc4N2)C
|
|
|
432
|
CCOC(=O)N[C@@H]1c2ccccc2O[C@@H]3[C@@H]1C=CC=C3
|
|
|
433
|
COC(=O)NS(=O)(=O)/C=C/N1C2CCCCC2C3C1CCCC3
|
|
|
434
|
c1ccc(cc1)c2c[nH]nc2c3ccc(cc3O)O
|
|
|
435
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
|
436
|
CCN1CNNC1C2C3CCCCC3SN2
|
|
|
437
|
Cc1cc(n(n1)c2c(c([nH]n2)C)N)C
|
|
|
438
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
|
439
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
|
440
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
|
441
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
|
442
|
CCOC1=C[C@@H](Oc2c1cccc2)c3ccc(cc3)F
|
|
|
443
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
|
444
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
445
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC(=O)c2ccccc2)CC=C
|
|
|
446
|
CC(=O)OC1CCC(C2C1CC=CC=C2)OC(=O)C
|
|
|
447
|
Cc1c(sc(n1)c2c(n(nn2)c3ccccc3)C)C(=O)[O-]
|
|
|
448
|
CCc1c(nco1)C(=O)N[C@@H]2CC(=O)N(C2)CC(C)(C)C
|
|
|
449
|
|
|
|
450
|
c1cc(sc1)C2=COC3(C2)CCN(CC3)C(=O)c4cnccn4
|
|
|
451
|
c1ccc2c(c1)c3c([nH]2)cccc3O
|
|
|
452
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
|
453
|
Cc1c(n(c-2n/c(=[NH+]/c3ccccc3)/ncc2n1)c4ccccc4)C
|
|
|
454
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
455
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
|
456
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
|
457
|
CO[C@@]12CCC(=O)N1C=CC3C2[NH]C4C3CCCC4
|
|
|
458
|
Cc1cc(=O)[nH]c2c1CCO2
|
|
|
459
|
CCC(=O)c1cc(c(c(c1)Sc2cccc3c2nccc3)O)C
|
|
|
460
|
Cc1nc2c(n1c3ccccc3)nc(s2)C
|
|
|
461
|
C[C@@H]1c2nc3ccccc3n2CN(CO1)c4ccc(cc4)F
|
|
|
462
|
c1ccc(cc1)[C@@H]2CCCn3c2cc4c3cccc4
|
|
|
463
|
Cc1cccc(n1)C#Cc2cccc(c2)c3ccco3
|
|
|
464
|
CN1CN(C(=C1c2cc[nH+]cc2)c3cc[nH+]cc3)C
|
|
|
465
|
COC1C2C(CC(OC2=O)C3CCCCC3)NC(N1)OC
|
|
|
466
|
COc1ccccc1C/C=C/c2cccs2
|
|
|
467
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
|
468
|
CCOc1c(c(=O)c1=O)/C=C/N(c3ccccc3S2)CC#C
|
|
|
469
|
c1ccc2c(c1)ncc(n2)c3cnc(nc3c4ccncc4)N
|
|
|
470
|
Cc1cc2n(c(=O)c1C#N)CC(=C2)c3ccccc3
|
|
|
471
|
CC1=Nc2ccccc2Nc3c1c(=O)[nH]c4c3cccc4
|
|
|
472
|
Cc1nc(cs1)c2nnc(n2c3cccc(c3)F)SC
|
|
|
473
|
CNC1=N[C@H](N(S1)c2ccccc2)c3ccccc3
|
|
|
474
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
|
475
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
|
476
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
|
477
|
COC(=O)Cc1c(c(=O)n(c(=O)o1)c2ccccc2)C(=O)OC
|
|
|
478
|
Cc1cc2c(c(nn2C)C)c(=O)n1Nc3ccccc3
|
|
|
479
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
|
480
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
|
481
|
CCOC(=O)c1c2n(c3c1ncnc3SC)CCC2
|
|
|
482
|
C1CCC(CC1)NN2CNC3C2C4CCCCC4CC3
|
|
|
483
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
|
484
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
|
485
|
c1ccc(cc1)C(=O)C2=Nc3ccccc3/C(=Cc4ccccn4)/N2
|
|
|
486
|
C1CCC2C(C1)-C3CNCNC3N=C(N2)N4CCCCC4
|
|
|
487
|
CN1c2ccccc2N[C@@H]3[C@@H]1[C@@H](C(=N3)OC)c4ccccc4
|
|
|
488
|
CC1(CC(=O)[C@@H]2[C@H](NC3CCCCC3CC2=N1)C4CCCNC4)C
|
|
|
489
|
C[C@@H]1Cc2c(cn[nH]2)C(=O)C1
|
|
|
490
|
Cc1c(nnn1c2cc(cnc2C#N)C(F)(F)F)C(=O)C
|
|
|
491
|
c1ccc(cc1)c2cc(c(o2)c3ccccc3)c4[nH]ccn4
|
|
|
492
|
c1ccc(cc1)Cc2cc(=O)c(c[nH]2)C(=O)N
|
|
|
493
|
c1ccc(cc1)c2nccn2c3ccnc(n3)Nc4ccccn4
|
|
|
494
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
|
495
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
|
496
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
|
497
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
|
498
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2sc(n3)N4CCCCC4)O
|
|
|
499
|
CCn1c2ccccc2n3c1nnc3c4cc(nn4C)C
|
|
|
500
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
|
501
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
|
502
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
|
503
|
[H]/N=c/n(cc(o1)c2ccc(cc2)CC)c3nc(cc(n3)C)C
|
|
|
504
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
|
505
|
Cn1c(c(c(=O)[nH]c1=O)Sc2nc3ccccc3s2)N
|
|
|
506
|
C1CCC(CC1)C2C(C3CNCCC3O2)C#N
|
|
|
507
|
CN(Cc1nnc(s1)SC)c2ccccc2F
|
|
|
508
|
CC1CC(N(C(=O)C1C#N)N/C=C/2C=NC3C2CCCC3)C
|
|
|
509
|
c1cc2c(cc1Cl)ncn3c2nn(c3=O)CC(=O)N
|
|
|
510
|
c1ccc2c(c1)CNc3ccccc3O2
|
|
|
511
|
c1cc(sc1)C2=C(C(=O)OC2)c3cccs3
|
|
|
512
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
|
513
|
c1ccc2c(c1)N(CCO2)C(=O)n3ccnc3
|
|
|
514
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
|
515
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
|
516
|
c1ccc2c(c1)[nH]c(n2)c3c(c4cccnc4s3)[O-]
|
|
|
517
|
Cc1cccc(c1N2CCc3c2[nH][nH+]c3)C
|
|
|
518
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
|
519
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
|
520
|
CCOC(=O)[C@@H]1[C@@H]2[C@@H](C3CCCCC3O2)C4CC(CCC4N1)CL
|
|
|
521
|
CCOc1ccc(c(c1)O)c2c(cn[nH]2)c3ccc(cc3)OC
|
|
|
522
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
|
523
|
Cc1c(c(on1)N)C2=CCN(CC2)C(=O)C
|
|
|
524
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
|
525
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
|
526
|
Cn1c(=O)c(c(cn1)Cl)[C@@H](C#N)c2nc3ccccc3s2
|
|
|
527
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
|
528
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
|
529
|
c1ccc2c(c1)c(c[nH]2)Cn3cnnc3
|
|
|
530
|
c1ccc2c(c1)cc(c(=O)o2)C3=CSC(=C4C=CC(=O)C=C4)[N-]3
|
|
|
531
|
c1ccnc(c1)N2[C@@H](N3CCC[C@@H]3C2=O)c4cccnc4
|
|
|
532
|
Cn1cc(nn1)NC(=O)c2ccc(cc2)Cn3cccc3
|
|
|
533
|
C/C(=C/C(=NC(=NC1=O)O)O)/Nc2cccc(c2)C(F)(F)F
|
|
|
534
|
CCOC(=O)C1=C([C@@H]2C=C(C=C[C@@H]2N=C1)C)OCC#N
|
|
|
535
|
|
|
|
536
|
c1cn(nc1CC(C(F)(F)F)(C(F)(F)F)O)C(=O)N
|
|
|
537
|
Cn1cc(cn1)c2cc3cc(ccc3nc2)C4=NCCC4
|
|
|
538
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
|
539
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
|
540
|
Cc1cc(ccc1F)C2=C[C@H]3C(=N2)CC(CC3=O)(C)C
|
|
|
541
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
|
542
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
|
543
|
c1ccc2c(c1)N=CC=C(S2)c3cccnc3
|
|
|
544
|
CCCCN1CC(=O)N=C1Nc2ccccc2
|
|
|
545
|
Cc1nc2c(s1)-c3c(cnc(n3)Nc4ccc(nc4)OC)CC2
|
|
|
546
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
|
547
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
|
548
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
|
549
|
Cc1ccc(cc1)n2c(c(nn2)C(=O)n3c(cc(n3)C)C)C
|
|
|
550
|
c1ccc(cc1)OC(=O)N2CC=C(C=C2)n3c4ccccc4nn3
|
|
|
551
|
c1c2c(co1)[nH]c(=O)c(=O)[nH]2
|
|
|
552
|
CC(=O)N1CCC(=C2c3ccccc3CCc4c2nccc4)CC1
|
|
|
553
|
C[C@@H]1c2nc(nn2[C@](C(=O)O1)(C)CC#C)[C@@H](C)O
|
|
|
554
|
COc1ccc2c(c1)CC[C@@H]3[C@@H]2O[C@@H](O3)c4cccnc4
|
|
|
555
|
C/C=C/C=C/C1CC2CC3C(C(C2C(=O)[NH]1)O)CCC3
|
|
|
556
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
|
557
|
CC(=O)n1c(c(nn1)CC#N)c2ccccc2
|
|
|
558
|
CC(=O)O[C@@H]1C=Cc2ccc3c4c2c1ccc4CC=C3OC(=O)C
|
|
|
559
|
c1ccc(cc1)/C=C/2CCCC3=C2NC(=O)N[C@@H]3c4ccccc4
|
|
|
560
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
|
561
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
|
562
|
c1ccc(cc1)c2nc(on2)c3c(c4ccccc4s3)O
|
|
|
563
|
c1ccc(cc1)N2Cn3c(=O)ccc(=O)n3C2
|
|
|
564
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
|
565
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
|
566
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
|
567
|
c1ccc(cc1)c2cn(c(=O)o2)c3ccccc3
|
|
|
568
|
CC1=CC(=O)O[C@@]1(CC(=O)C2CCCCC2)O
|