(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
|
2
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
|
3
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
|
4
|
CC1C(C(=O)NC([NH]1)N)N2C(=O)C3CCCCC3NN2
|
|
|
5
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
|
6
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
|
7
|
c1cc(sc1)c2cc(nc3c2c(c(o3)C(=O)[O-])N)C(F)(F)F
|
|
|
8
|
Cc1ccc(cc1)S(=O)(=O)Nn2c(c(nn2)c3ccccc3)C
|
|
|
9
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
|
10
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
|
11
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
|
12
|
Cn1c2c(cn1)c(ncn2)Sc3nnc(o3)c4cccnc4
|
|
|
13
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
|
14
|
|
|
|
15
|
CC1(OC[C@H]([C@H](O1)c2cccnc2)C/C=CCCC(=O)[O-])C
|
|
|
16
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
|
17
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
|
18
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
|
19
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
|
20
|
|
|
|
21
|
Cc1c2c(nc(c(n2)c3ccc(nc3)OC)[O-])nc(n1)SC
|
|
|
22
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
|
23
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
|
24
|
Cc1c(oc2c1cc(c(c2)OC)/C(=C/C(=N/c3[nH]ncn3)/[O-])/C)C
|
|
|
25
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
|
26
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
|
27
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
|
28
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
|
29
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
|
30
|
CN1CC(=C(C1=O)O)c2ccc(cn2)Cc3ccc(cc3)F
|
|
|
31
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
|
32
|
Cc1cc(=O)n2c(n1)sc(n2)Cn3nc(nn3)c4ccccc4
|
|
|
33
|
Cc1c(c(nc(n1)C)SCc2nnc(s2)SC)C(=O)C
|
|
|
34
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
|
35
|
Cc1c2c(n[nH]1)Oc3c(c(c(c(=O)[nH]3)C#N)N)[C@@H]2c4ccccc4
|
|
|
36
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
|
37
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
|
38
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
39
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
|
40
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
|
41
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
|
42
|
CC(C)(C)CN1C[C@@H](CC1=O)NC(=O)CCc2cnccn2
|
|
|
43
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
44
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
|
45
|
|
|
|
46
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
|
47
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
|
48
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
|
49
|
Cc1cc2c(n[nH]c(=O)c2c(=O)[nH]1)Cc3ccco3
|
|
|
50
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
|
51
|
|
|
|
52
|
c1ccc(cc1)c2c(oc3n2c(=O)ccc(=O)n3)c4ccccc4
|
|
|
53
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
|
54
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
|
55
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
|
56
|
COc1ccc(cc1OC)/C=C/c2nc(on2)c3ccccc3O
|
|
|
57
|
Cc1c2c(c3ccccc3n1)-n4cnnc4SC2
|
|
|
58
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
|
59
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
|
60
|
CN1CCc2c(c(nc3c2c(n[nH]3)N)Nc4ccc(cc4)OC)C1
|
|
|
61
|
Cc1ccc(nc1)C[S@@](=O)C2=NC3=CS[C@H](C3=N2)C(=O)C
|
|
|
62
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
|
63
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
|
64
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
|
65
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
|
66
|
CCCSc1ncc(cn1)CN2CCCn3c(cc(n3)C#N)C2
|
|
|
67
|
CC(=O)N1CCC(CC1)c2nc3c(c(n2)[O-])nccn3
|
|
|
68
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
|
69
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
|
70
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
|
71
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
|
72
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
|
73
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2c(=O)c3ccccc3nn2
|
|
|
74
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
|
75
|
Cc1cc([nH]c1/C=C/C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
76
|
COc1ccc(cc1)[C@@H]2C(=NC(=O)N2)c3ccc(cc3)OC
|
|
|
77
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
|
78
|
C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NCCCc4[n-]nnn4)C
|
|
|
79
|
c1cscc1c2cnc(c(n2)N3CCC[C@@H](C3)CCCO)N
|
|
|
80
|
Cc1c2c(nc(n1)n3cc(nn3)c4ccccc4)CCCC2
|
|
|
81
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
|
82
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
|
83
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
|
84
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
|
85
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
|
86
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
|
87
|
c1cc(ccc1c2csc3n2cnc-4ncnc34)Cl
|
|
|
88
|
c1ccc2c(c1)c3c(nn2)nn4c(=O)cc(nc4n3)C(F)(F)F
|
|
|
89
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
|
90
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
|
91
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
|
92
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
|
93
|
Cc1[nH]n2c(n1)c(c3c2nc4ccccc4n3)C(=O)NCCOC
|
|
|
94
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
|
95
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
|
96
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
|
97
|
CC(C)c1c(cn(n1)C)c2[nH]c3cc(cnc3n2)Br
|
|
|
98
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
|
99
|
Cc1cc(c(s1)C)c2c(c(oc2c3cc(sc3C)C)N)C#N
|
|
|
100
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
|
101
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
|
102
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
|
103
|
CNC(=O)N(C)C1=N[C@@](C(=N1)C2CCCCC2)(C3CCCCC3)O
|
|
|
104
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
|
105
|
CSc1c(c(c(s1)c2cc[nH]n2)c3ccco3)C#N
|
|
|
106
|
c1ccc2c(c1)c(c-3c(n2)CSc4c3cc(cc4)Cl)C(=O)[O-]
|
|
|
107
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
|
108
|
c1ccc(cc1)Oc2ccccc2c3cc4c(nc3)nn[nH]4
|
|
|
109
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
|
110
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
|
111
|
Cn1c(=O)c(nn(c1=O)c2ccc(cc2F)F)c3ccn[nH]3
|
|
|
112
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
|
113
|
CN1C2C(C(=O)N(C1=O)C)NC3C4CCCCC4OC3N2
|
|
|
114
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
|
115
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
|
116
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
|
117
|
c1ccc(c(c1)N)Nc2c(cn(c(=O)n2)Cc3cccs3)C#N
|
|
|
118
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
|
119
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
120
|
Cc1cc(sn1)[C@@H](c2ccc(cc2)C(C)C)Nc3cccnc3
|
|
|
121
|
Cc1ccc(=O)n(c1)C(=O)c2cc(cc(n2)c3ccccc3)OC
|
|
|
122
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
|
123
|
|
|
|
124
|
Cc1c(c(n(n1)c2ccccc2)C)C(=O)n3c(ncn3)N
|
|
|
125
|
c1[nH]c(=O)c2c(n1)Oc3c(c(=O)[nH]cn3)C2
|
|
|
126
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
|
127
|
C1CCC(CC1)C#C[C@@]2(C3CCCCC3C(=O)C4C2CNCC4)O
|
|
|
128
|
Cc1nc(on1)S[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
|
129
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
|
130
|
CCc1cc2c(cnc(c2o1)OC)C(=O)Nc3c(cncn3)C#N
|
|
|
131
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
|
132
|
CCn1c2ccccc2n(c1=O)Cc3nnc(s3)SC
|
|
|
133
|
C[C@@H]1CCCN(C1)C(=O)c2c(c(ns2)c3ccccn3)N
|
|
|
134
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
|
135
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
|
136
|
|
|
|
137
|
CC1(Cc2c(cc3c4c([nH]c(=O)[nH]4)sc3n2)CO1)C
|
|
|
138
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
|
139
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
|
140
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
|
141
|
Cc1ccc(cc1)[S@@](=NC(=O)C)(=O)Oc2ccccc2
|
|
|
142
|
Cc1cc(nc(n1)n2c(=O)ccc(n2)[O-])C
|
|
|
143
|
c1cc(cnc1)c2nnc(s2)Cc3cccs3
|
|
|
144
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
|
145
|
C1CCC(CC1)/C=C/C=C/C2C(=O)[NH]C(=O)[NH]N2
|
|
|
146
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
|
147
|
|
|
|
148
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
|
149
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
|
150
|
c1ccc2c(c1)c(=O)c(c3n2CC(=O)N3)c4[nH]c5ccccc5n4
|
|
|
151
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
|
152
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
|
153
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
154
|
c1ccnc(c1)c2cn(nn2)C3CCN(CC3)C(=O)C4CC4
|
|
|
155
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
|
156
|
c1ccc(cc1)c2cc3nc(c4c(n3n2)nc(o4)c5ccccc5)N
|
|
|
157
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
|
158
|
c1ccc(cc1)N2CCN3[C@@H]2c4ccccc4C3=O
|
|
|
159
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
|
160
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
|
161
|
c1ccc(cc1)c2nnn(n2)Cn3c(=O)c4ccccc4nn3
|
|
|
162
|
Cn1c(cc(n1)Oc2ccc(cn2)C(F)(F)F)C(F)(F)F
|
|
|
163
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
|
164
|
CC(=CC[C@@]1(c2c(c(c3ccoc3n2)OC)CC[C@@H]1O)OC)C
|
|
|
165
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
|
166
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
|
167
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
|
168
|
c1ccc2c(c1)ccc(c2C3=c4ccccc4=CC[C@@]3(N)O)O
|
|
|
169
|
|
|
|
170
|
Cn1c(=O)c(c(cn1)[C@@H](C#N)c2[nH]c3ccccc3n2)Cl
|
|
|
171
|
Cc1c(sc(n1)c2c(n(nn2)c3ccccc3)C)C(=O)[O-]
|
|
|
172
|
c1ccc2c(c1)c3c([nH]2)nc4c(n3)non4
|
|
|
173
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
|
174
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
|
175
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
|
176
|
c1ccc2c(c1)[C@@H]3[C@H]4C(=Nc5ccccc5N3C2=O)CCCC4=O
|
|
|
177
|
CC(C)(C)OC(=O)Nc1c[nH]nc1
|
|
|
178
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
|
179
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
|
180
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
|
181
|
c1ccc(cc1)OCc2[nH]c(c/c(=N/c3ccc(cc3)Cl)/n2)O
|
|
|
182
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
|
183
|
CC(C)(C)OC(=O)N1CCC(=CC1)C#Cc2ccccn2
|
|
|
184
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
|
185
|
c1ccc(cc1)Nc2c(nnn2c3ccccc3)c4ccn[nH]4
|
|
|
186
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
|
187
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
|
188
|
Cc1c(ccnc1COc2nc3ccccc3o2)OCC(C)C
|
|
|
189
|
CCOC(=O)c1cnn2c1nnn(c2=O)c3ccccc3
|
|
|
190
|
COc1c2c(ncn1)Sc3c(ncnc3OC)N2
|
|
|
191
|
|
|
|
192
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
|
193
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
|
194
|
Cc1nc2c3c(ncn2n1)OC4=NN=C([C@H]4[C@H]3c5ccccc5)C
|
|
|
195
|
|
|
|
196
|
CCCCCNC1=[NH+]C(=N/C(=C/C=C(C=CC2=O)Cl)/N1)N
|
|
|
197
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
|
198
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
|
199
|
COCCCn1cnc2c(c1=O)c3c(o2)nc4ccccc4n3
|
|
|
200
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
|
201
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
|
202
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
|
203
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
|
204
|
COC(=O)c1c2c(nnc(n2nc1C(=O)OC)[O-])c3ccccc3
|
|
|
205
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
|
206
|
Cc1cc(nc(n1)N)n2c(cc(n2)c3ccco3)C(F)(F)F
|
|
|
207
|
C1CCCC(C1)C(=C/C2=C/C3CCNCC3)[C@@H](C4CCNCC4)O
|
|
|
208
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
|
209
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
|
210
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
|
211
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
212
|
c1ccc(c(c1)/C=c/c(n/c(=C/C(=O)N3CCCC3)/s2)[O-])O
|
|
|
213
|
CN1C=C[C@@H]2c3ccccc3[C@@H](C2=C1)c4ccccc4
|
|
|
214
|
CC(C)(C)c1cc(no1)n2c(=O)c3ccccc3[nH]c2=O
|
|
|
215
|
c1ccc2c(c1)CC3=C2NC(=O)N[C@@H]3c4ccccn4
|
|
|
216
|
Cc1ccc(cc1)c2nnn(n2)CCn3c4ccccc4oc3=O
|
|
|
217
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
|
218
|
C[C@@H](c1ccncn1)N(C)Cc2ccc(o2)Sc3ncccn3
|
|
|
219
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
|
220
|
CCOC(=O)c1c(c2c(nc(nc2n1C)c3ccccc3)C)N
|
|
|
221
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
|
222
|
Cc1cc(nc(n1)SC)n2ccc(=O)[nH]c2=O
|
|
|
223
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
|
224
|
c1ccc(cc1)C(=O)c2c3n(nn2)CC(=O)OC34CCCCC4
|
|
|
225
|
c1ccc2c(c1)C[C@@H]3C(=O)N=C(N3C2)Nc4ccccc4F
|
|
|
226
|
c1cn(c(n1)CN(Cc2nnnn2C3CC3)C4CC4)C(F)F
|
|
|
227
|
|
|
|
228
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
|
229
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
|
230
|
CCOC(=O)c1c(c2c(cccc2s1)F)Cn3cnc(n3)C#N
|
|
|
231
|
C1CC(CCC1NC(=O)C2=C([C@@H]3C=C[C@H]2O3)C(=O)[O-])CL
|
|
|
232
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3c(=O)ccc(n3)c4ccco4
|
|
|
233
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
|
234
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
|
235
|
COC(=O)c1c(=O)n([nH]n1)Cc2cccs2
|
|
|
236
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
|
237
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
|
238
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
|
239
|
CCCCCCC1CN[NH]N1
|
|
|
240
|
c1cc2c(cc1C3=CNC(=O)CO3)cc([nH]2)c4ccncc4
|
|
|
241
|
Cc1cc(c(nn1)[O-])c2nc3ccccc3n2C
|
|
|
242
|
CC(=O)Nc1cc2c(s1)C3(CCCCC3)CC(=O)N2
|
|
|
243
|
CCOC(=O)[C@@H]1C2C(NC3CCCCC3N2)N4[C@@H]1CCC4
|
|
|
244
|
c1cc(cnc1)C#CCCN2CCC(=CC2)c3cccs3
|
|
|
245
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
|
246
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
|
247
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
|
248
|
c1ccc2c(c1)ncn2/C=C/NC(=O)c3ccc(cc3)Cl
|
|
|
249
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
|
250
|
Cc1cn(c(n1)c2cccnc2)c3ccc(cc3)S(=O)(=O)C
|
|
|
251
|
Cc1ccc(cc1)C(=O)Nc2cc(c(n(c2=O)N)C)c3cc[nH]n3
|
|
|
252
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
|
253
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
|
254
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
|
255
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
|
256
|
C1CCC(CC1)/C=C/2CC-3OC(=O)C4C3C(C2=O)CCC4
|
|
|
257
|
CSc1nnc(s1)CN2CCSc3c2cccc3
|
|
|
258
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
|
259
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
|
260
|
Cc1ccc(cc1)c2nnn(n2)c3c4c(c5ccccc5o4)ncn3
|
|
|
261
|
CN(C)c1ccc(cc1)[C@@H]2NC[C@@H](O2)CSc3ccccn3
|
|
|
262
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
|
263
|
CCNc2ccccc2S/C1=Cc3nc4ccccc4s3
|
|
|
264
|
Cc1c2ccccc2[nH]c(=O)c1Sc3nnnn3C
|
|
|
265
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
|
266
|
c1ccn(c1)c2ccc(cc2)SCC(=O)[O-]
|
|
|
267
|
CC1(Nc2c(nnc(n2)SCC(=O)[O-])-c3ccccc3O1)C
|
|
|
268
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
|
269
|
CC1([C@@H]2CC[C@]1(c3c2nc(c(n3)C#N)C#N)C(=O)[O-])C
|
|
|
270
|
Cc1ccc(cc1)S(=O)(=O)Nn2nc(nn2)c3ccccc3
|
|
|
271
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
|
272
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
|
273
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
|
274
|
c1ccc(cc1)CN2CCc3c(c4cccc5c4n3CC(=O)N5)C2
|
|
|
275
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
|
276
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
|
277
|
CCS(=O)(=O)c1ccc(s1)c2cccc(c2)c3cc[nH]n3
|
|
|
278
|
|
|
|
279
|
CCOC(=O)C1=C(NC(=O)c2c(ccc(c2OC)OC)[C@@H]1O)C
|
|
|
280
|
c1ccc(cc1)C2=N[C@@H]3N(C2)c4ccc(cc4S3)C(=O)[O-]
|
|
|
281
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
282
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
|
283
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
|
284
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
|
285
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
|
286
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
|
287
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
|
288
|
|
|
|
289
|
Cc1cc(nc(n1)[N-]C2=NC(=O)C[C@@H]3N2CCNC3=O)C
|
|
|
290
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
|
291
|
|
|
|
292
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
|
293
|
c1ccc(cc1)C2=CC(NC=N2)(c3ccccc3)c4ccccc4
|
|
|
294
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
|
295
|
c1ccc(cc1)c2c(c3ccc(nc3[nH]2)C(=O)[O-])C4CCCCC4
|
|
|
296
|
CNC1=[NH+][C@@H](N(S1)c2ccccc2)c3ccccc3
|
|
|
297
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
|
298
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
|
299
|
CC1=C[C@@H](c2c(=O)[nH]c(=O)[nH]c2O1)c3ccccc3
|
|
|
300
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
|
301
|
CCCCN1c2cccnc2-c3c(cccn3)N=C1c4ccccc4
|
|
|
302
|
Cc1c(c(on1)C)/C=C/c2c(=O)[nH]c3ccccc3n2
|
|
|
303
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
|
304
|
CN1[C@@H]([C@H](CC1=O)c2ccccc2)[C@H](C#Cc3ccccn3)O
|
|
|
305
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
|
306
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
|
307
|
c1ccc(cc1)c2nnc(o2)Sc3nc4ccccc4s3
|
|
|
308
|
CC1([C@@](c2ccccc2O1)(c3ccc4ccccc4n3)O)C
|
|
|
309
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
|
310
|
C[C@@H](C(=O)c1cn(nn1)c2ccc(cc2)C(=O)C)n3cncn3
|
|
|
311
|
C1CCC(CC1)COC(=O)N[C@@H](CC(=O)N)C2[N-]NNN2
|
|
|
312
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
|
313
|
c1ccc(cc1)n2c(c(c(nc2=O)Cn3cncn3)C#N)N
|
|
|
314
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
|
315
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
|
316
|
CC1CNC(S1)/N=C/2N(CC(S2)C)C3NCC(S3)C
|
|
|
317
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
|
318
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
|
319
|
COC1=CC=C2[C@@H](N1)Sc3c(=O)[nH]c(nc3N2)N
|
|
|
320
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
|
321
|
c1ccc2c(c1)nc(o2)c3nc4ccccc4s3
|
|
|
322
|
c1cc(ccc1[C@@H](c2c(nc3nnc(n3n2)N)[O-])C(=O)[O-])Cl
|
|
|
323
|
C1CCC(CC1)C(=O)C2C3CCCCC3C4N2C(=O)[NH]C(=O)[NH]4
|
|
|
324
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
|
325
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
|
326
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
|
327
|
[H]/N=C/[C@@H](c2c(nc3ccccc3n2)Sc4ccccc4N1)C#N
|
|
|
328
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
|
329
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
|
330
|
CC(=C)c1nc(nc(n1)Oc2ccccc2)Oc3ccccc3
|
|
|
331
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
|
332
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
|
333
|
CCSc1ncc(n1C)c2cc(c3ccccc3n2)C(=O)[O-]
|
|
|
334
|
Cc1c(=O)n2c(nn1)SCC(=O)N2
|
|
|
335
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
|
336
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
|
337
|
CC(=CC[C@@H]1[C@@H](CCC1=O)c2cc(on2)Cc3ccccc3)C
|
|
|
338
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
|
339
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
|
340
|
Cc1csc(n1)SCC2=NS(=O)(=O)c3ccccc3N2
|
|
|
341
|
Cn1cc(c(n1)c2ccncc2)c3ccc4c(c3)C(=O)NC4
|
|
|
342
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
|
343
|
Cc1c(c(nc(c1Cl)C)S(=O)(=O)NC2CC2)C#N
|
|
|
344
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
|
345
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
|
346
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3ccc4c(c3)OCO4
|
|
|
347
|
C[C@@H]1CN2C(C(C(=O)[NH]C2=O)C3CCCCC3)O1
|
|
|
348
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
|
349
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
|
350
|
Cn1c(=O)c2ccccc2c(n1)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
351
|
Cc1csc(n1)c2cn[nH]c2N
|
|
|
352
|
c1ccc(cc1)C2=NCCNC(=O)C2
|
|
|
353
|
CCOC(=O)N1CCN(CC1)C2NNC3NCCN3N2
|
|
|
354
|
C[C@@H]1CC2=C([C@@H](Sc3ccccc3N2)c4ccccc4)C(=O)C1
|
|
|
355
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
356
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
|
357
|
COC1CCC(CC1)/C=C/2C(=C)[NH]N(C2=O)CC3CCCCC3
|
|
|
358
|
c1ccc(cc1)n2cc(cn2)CN3CCSc4c3cccc4
|
|
|
359
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
|
360
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
|
361
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
|
362
|
|
|
|
363
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
|
364
|
c1ccc2c(c1)nc3n2[C@@H](NC(=[NH+]3)N)c4ccco4
|
|
|
365
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
|
366
|
Cc1cc(c(c(c1)C)Nc2nc(nc(n2)N3CCC=CC3)C)C
|
|
|
367
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
|
368
|
C1CCC2C(C1)CC[C@@H]2CC3CCCCN3
|
|
|
369
|
Cc1ccccc1CN[C@@H]2COC[C@H]2c3ccc(cc3)F
|
|
|
370
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
|
371
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
|
372
|
c1ccc(cc1)CN2C[C@@H](c3c2ncc(n3)c4ccccc4)C#N
|
|
|
373
|
C/C(=C/C(=NC(=NC1=O)O)O)/Nc2cccc(c2)C(F)(F)F
|
|
|
374
|
Cc1c(=O)n2c(nn1)n(cn2)Cc3ccccc3
|
|
|
375
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
|
376
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
|
377
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
|
378
|
CC1([C@@H]2CCC(=C)[C@@H](C2)C(=N1)C(=O)C3C[NH]C4C3CCCC4)C
|
|
|
379
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
|
380
|
CSc1nc(cc(n1)n2cnc3c2cccc3)c4ccccc4
|
|
|
381
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
|
382
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
|
383
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
|
384
|
c1nc2c(n3c(c2c(=O)n1CCC#N)CCC3)C#N
|
|
|
385
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
|
386
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
387
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
|
388
|
Cc1cc(nc(n1)n2c(c(c(=O)c(n2)C)c3ccccc3)N)C
|
|
|
389
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
|
390
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
|
391
|
Cn1c(=O)[nH]c(=O)n2c1ncc2CC(=O)Nc3ccccc3
|
|
|
392
|
c1ccc2c(c1)C(=O)NS(=O)(=O)c3ccccc3S2
|
|
|
393
|
Cc1ccc(cc1)S(=O)(=O)Oc2cc(nn2C)C(F)(F)F
|
|
|
394
|
Cc1c2cc(cnc2n(n1)C)[N-]S(=O)(=O)c3cccs3
|
|
|
395
|
|
|
|
396
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
|
397
|
Cn1c(cc(=O)n(c1=O)C)Cn2nc(nn2)c3ccccc3
|
|
|
398
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
|
399
|
Cc1ccc(cc1)S(=O)(=O)n2c(nnn2)[O-]
|
|
|
400
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
|
401
|
CC(C)(C)OC(=O)N1c2cscc2-c3cccnc3[C@@H]1O
|
|
|
402
|
CC1(Cc2c(cc3c(n2)Nc4ccccc4N=C3O)CO1)C
|
|
|
403
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
|
404
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
|
405
|
C[C@@H]1Cc2nc(cc(=O)n2N1c3ccccc3)[O-]
|
|
|
406
|
c1ccc2c(c1)C(=O)[C@@]3([C@@]2(Nc4c(non4)N3)O)O
|
|
|
407
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
|
408
|
CCOC(=O)c1c(c(cn1C)NC(=O)OCc2ccccc2)O
|
|
|
409
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
|
410
|
Cc1cc(nc(n1)Nn2c(cc(c(c2=O)C(=O)C)[O-])C)C
|
|
|
411
|
c1ccc(cc1)[C@@H]2C=CNC(=N2)Nc3nc4ccccc4o3
|
|
|
412
|
c1ccc(cc1)[C@@H]2C3=C(c4ccccc4CC3)NC(=O)N2
|
|
|
413
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
|
414
|
|
|
|
415
|
c1ccc(cc1)Oc2c(c3ccccc3[nH]2)c4ccco4
|
|
|
416
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
|
417
|
CCOC(=O)c1nn(c2n1c(=O)cc(n2)N)c3ccccc3
|
|
|
418
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
|
419
|
Cc1nc2ccc(cc2s1)n3c(c(nn3)[O-])C#N
|
|
|
420
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
|
421
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
|
422
|
Cc1nn2cc(nc2s1)Cn3cnc4c(c3=O)cccc4OC
|
|
|
423
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
|
424
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
|
425
|
Cc1c2c([nH]c(=O)n(c2=O)Nc3ccc(cc3)O)sn1
|
|
|
426
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
|
427
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
|
428
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
|
429
|
c1ccc(cc1)n2c(noc2=O)c3cccnc3
|
|
|
430
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
|
431
|
CC(C)N1C(=O)C2NN3C(C(=O)N(C3=O)C(C)C)NN2C1=O
|
|
|
432
|
c1ccc(cc1)C(=O)[C@@H]2C[C@@H]([C@@H]3N2c4ccccc4C=C3)C#N
|
|
|
433
|
COc1cc(nc(c1)C(=O)Nc2[n-]nnn2)c3ccc(cc3)N
|
|
|
434
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
|
435
|
c1ccc(cc1)c2ncc(cn2)OC(=O)Cc3ccccc3F
|
|
|
436
|
CC(=O)c1c(nn(n1)c2ccc(cc2)F)Nc3ccc(nc3)OC
|
|
|
437
|
CC(C)(C)c1cc(c2c([o+]1)-c3ccccc3OC2)c4ccccc4
|
|
|
438
|
C1CCC(CC1)C[S@@](=O)C2CCCCC2CN3CCCC3
|
|
|
439
|
c1ccc(cc1)[C@@H]2NC(=[NH+]C(=N2)c3ccccc3)c4ccccc4
|
|
|
440
|
c1nc(c2n1CC(=O)NC2)C(=O)N
|
|
|
441
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
|
442
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
|
443
|
CCc1cc(c(cc1OC)O)c2c(cn[nH]2)c3nc(cs3)C
|
|
|
444
|
|
|
|
445
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
|
446
|
c1ccc(cc1)c2ccc(cc2)c3cc(c4c(n3)ocn4)C(=O)[O-]
|
|
|
447
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
|
448
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
|
449
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
|
450
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
|
451
|
Cc1ccc(cc1)c2c(sc(n2)C)Cc3nnc(o3)N
|
|
|
452
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
|
453
|
CCOC(=O)c1c(c(ccc1N(C)C)[C@@H]2C=CNC(=O)N2)C
|
|
|
454
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
455
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
|
456
|
C[C@H]1c2c(c(=O)cc-3n2CCc4c3cccc4)C(=O)O1
|
|
|
457
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
|
458
|
C[C@@H]1C2=C(CC(=O)N=C2C)C(=O)N1Cc3ccccc3
|
|
|
459
|
|
|
|
460
|
C=CC[C@@H]1CC=C[C@H](N1C(=O)c2[nH]ccn2)c3ccccc3
|
|
|
461
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
|
462
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
|
463
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
|
464
|
Cc1c(sc(n1)NC(=O)C)c2nc(no2)c3ccccc3
|
|
|
465
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
|
466
|
CC(=O)NC1=N[C@@H](CC(=O)N1)c2ccc(cc2)OC
|
|
|
467
|
CCNc1c(cc(c2c1nccc2)Cc3cnc(nc3N)N)C
|
|
|
468
|
C1CCC(CC1)C(=O)C#CC2C[NH]C(=O)[NH]C2=O
|
|
|
469
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
470
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
|
471
|
C1CCC(CC1)C2=CC(=C[C@@](O2)(C3CCCCC3)O)C4CCCCC4
|
|
|
472
|
CCSc1nnc(n1C)CSc2c([nH]c3c2cccc3)C
|
|
|
473
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
|
474
|
c1ccc2c(c1)c(=O)n-3c(n2)C(=O)c4c3cccc4
|
|
|
475
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
|
476
|
Cc1nc2ccccc2c(=O)n1N(c3ccccc3)C4=CC=CCC4
|
|
|
477
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
|
478
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
|
479
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
|
480
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
|
481
|
COc1ccc(cc1)c2cc-3n(n2)C(=O)c4c3cccc4
|
|
|
482
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
483
|
c1nc-2c3nc(on3cnc2n1)[O-]
|
|
|
484
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC=C)CCn2cccn2
|
|
|
485
|
Cn1c(ccn1)[C@@H]2C(=C(C(=O)O2)[O-])c3ccc4ccccc4n3
|
|
|
486
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
|
487
|
c1ccc(cc1)c2nc(cs2)Cn3c4ccccc4nn3
|
|
|
488
|
CCCN(CCC)c1cc(nc2c1nn(c2c3ccccc3)C)C
|
|
|
489
|
CCCCN1c2cccnc2-c3c(cccn3)N(C1=O)CCCC
|
|
|
490
|
c1ccc-2c(c1)-c3cccc4c3c2cnc4
|
|
|
491
|
CCOC(=O)N1CCC(=CC1)c2c(nn(c2N)C)C
|
|
|
492
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
|
493
|
CCOc1ccc(cc1)n2c3c4ccccc4[nH]c3cc(c2=O)N
|
|
|
494
|
Cc1nc(nc(=O)n1c2ccccc2)Nc3ccccc3
|
|
|
495
|
COC1=C[C@@]23CCCN2CCc4cc5c(cc4[C@@H]3[C@@H]1O)OCO5
|
|
|
496
|
CC(C)(C)c1ncc(s1)c2nc3c(cccn3)c(n2)[O-]
|
|
|
497
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
|
498
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
|
499
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
|
500
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
|
501
|
c1ccc(cc1)c2nnc(o2)Cn3c4ccccc4sc3=O
|
|
|
502
|
COC1(C=CC(C=C1)(c2ccccc2C=C)O)OC
|
|
|
503
|
COCCN1[C@@H]([C@@H](C1=O)Sc2ccccc2)c3cccs3
|
|
|
504
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
|
505
|
c1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)[O-]
|
|
|
506
|
COc1ccc(cc1)/N=C/Cc2nc(c(s2)C#N)C(F)(F)F
|
|
|
507
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
|
508
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
|
509
|
C1C2CC3CC1CC(C2)(C3)n4nc(c(n4)C(=O)[O-])C(=O)[O-]
|
|
|
510
|
c1ccc(cc1)[C@@]2(CCn3c4c2cccc4nn3)O
|
|
|
511
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
|
512
|
[H]/N=C/1NC(=C2C(=Nc3ccc(nc3S2)OC)[N-]1)N
|
|
|
513
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
|
514
|
Cc1cc2n3c(cc(n3)C)n4c(n2n1)cc(n4)C
|
|
|
515
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
|
516
|
CC1(C=C2c3cccc(c3C(=O)N2c4c1cccc4)C(=O)[O-])C
|
|
|
517
|
C1NC-2C3NN[N-]N3CNC2N1
|
|
|
518
|
Cc1c(c2nc(c3c(n2n1)OCC3)C(=O)[O-])c4ccccc4
|
|
|
519
|
CSc1nnc(n1c2ccccc2)c3cc4c([nH]3)cco4
|
|
|
520
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
|
521
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
|
522
|
c1c[nH]nc1Nc2c(nc(c(n2)Cl)Cl)Cl
|
|
|
523
|
|
|
|
524
|
c1ccc(cc1)c2nc3n(n2)Cc4ccccc4C35CCOCC5
|
|
|
525
|
Cc1cc(c(nn1)N)C(=O)N
|
|
|
526
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
|
527
|
c1ccc(cc1)n2nc3ccc4c(c3n2)non4
|
|
|
528
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
|
529
|
CC(=O)N[C@H]1c2nc(cn2[C@@H]([C@H]([C@@H]1O)O)CO)CC(=O)[O-]
|
|
|
530
|
CCC1=C([C@@H](C2=C(N1)CCCC2=O)c3ccccc3)C(=O)OCC
|
|
|
531
|
Cc1c(snn1)c2nnc(o2)C3CCCCC3
|
|
|
532
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
|
533
|
c1cc(ccc1c2cc(n(n2)C(=O)c3c(n[n-]n3)Cl)N)Cl
|
|
|
534
|
CC(C)CN(Cc1cnc(nc1)COC)Cc2cnn(c2)C
|
|
|
535
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
|
536
|
C1CCC2(CC1)C3=C(CCCC3)n4c(nc(n4)N)N2
|
|
|
537
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
|
538
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
|
539
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
|
540
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
|
541
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
|
542
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
|
543
|
CC1C(C(N[NH]1)C2CCON2)N
|
|
|
544
|
Cc1c(c(n(n1)C)Sc2ccc(cc2)Cl)C(=O)N
|
|
|
545
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
|
546
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
|
547
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
|
548
|
Cc1nc([nH]n1)/N=C(/N2CCc3cc(c(cc3C2)OC)OC)[O-]
|
|
|
549
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
|
550
|
c1ccc(cc1)[C@@H]2C=C(N=C3C2=C(NC(=O)N3)[O-])c4ccccc4
|
|
|
551
|
C1CCc2nn3c(n2CC1)c(c(nc3=O)SCC(=O)N)C#N
|
|
|
552
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
|
553
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
|
554
|
CCOc1ccc(cc1C)c2nnc(n2c3ccc(nc3)OC)C
|
|
|
555
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
|
556
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
|
557
|
CC1(Cc2cc(ccc2CO1)S(=O)(=O)Nc3ccccc3)C
|
|
|
558
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
|
559
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2sc(n3)N4CCCCC4)O
|
|
|
560
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
|
561
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
|
562
|
CC(=O)Nc1nc2ccc(cc2s1)c3nc4ccccc4o3
|
|
|
563
|
c1ccc2c(c1)[C@@H]3N(C2=O)c4ccccc4S3
|
|
|
564
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
|
565
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
|
566
|
Cc1csc(=O)n1CCC(=O)[C@@H](C#N)c2ccccn2
|
|
|
567
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
|
568
|
CCn1c(c(c2c1nc3ccccc3n2)c4[nH]c5ccccc5n4)N
|