24 SMILES Strings for Ubiquitin carboxyl-terminal hydrolase isozyme L5
Compound Name
SMILES String
CC(=O)Nc1ccc(cc1)-c1cn(Cc2cc(cc(c2)-c2ccccc2C(O)=O)C(O)=O)nn1
CC(=O)Nc1cccc(c1)-c1cn(Cc2cc(cc(c2)-c2ccccc2C(O)=O)C(O)=O)nn1
CC(=O)ON=C1C(=O)N(Cc2cc(Cl)ccc2Cl)c2ccc(Cl)cc12 |w:4.3|
CC(C(O)=O)c1ccc(s1)C(=O)c1cccc(c1)-c1ccccc1C(O)=O
CC(C(O)=O)c1ccc(s1)C(=O)c1cccc(c1)-c1occc1C(O)=O
CC(C(O)=O)c1ccc(s1)C(=O)c1ccccc1
CC(C)c1ccccc1-c1ncc(C)c(NCc2ccc(cc2)-n2ccnn2)n1
CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]2(C)CC[C@@]2(C)[C@@H]3C[C@@](C)(CC[C@]3(C)CC[C@]12C)C(O)=O |r,c:1,6,11,t:9|
COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@@H]3C[C@H]12 |t:4|
CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C2=O)c2C(=O)\C(=C\NN4CCN(C)CC4)C(NC(=O)\C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)=C(O)c2c(O)c3C |wU:45.47,41.43,37.39,43.45,35.37,6.6,wD:2.1,39.41,50.53,c:33,t:3,35,54,(15.1,-5.61,;13.64,-5.11,;13.35,-3.6,;14.73,-2.92,;16.01,-3.78,;17.39,-3.1,;17.5,-1.56,;18.99,-1.94,;18.12,-.17,;16.98,.86,;15.65,.09,;15.97,-1.41,;16.45,-2.87,;14.32,.86,;12.94,.04,;14.28,-.72,;11.54,.83,;10.21,.05,;9.44,1.38,;9.43,2.92,;8.1,3.69,;8.09,5.23,;9.42,6,;9.42,7.54,;10.76,5.24,;10.76,3.7,;11.54,2.43,;10.16,1.76,;9.14,.62,;9.33,-.91,;7.86,1.48,;7.43,2.96,;6.47,.8,;6.37,-.73,;4.99,-1.41,;4.49,-2.87,;3.08,-2.24,;5.5,-4.03,;4.48,-5.18,;7.04,-4.13,;6.8,-5.65,;7.9,-2.85,;7.67,-1.33,;9.41,-2.56,;10.9,-2.2,;10.69,-3.42,;10.98,-4.93,;10.48,-6.38,;11.5,-7.54,;8.97,-6.68,;12.07,-2.74,;13.58,-2.44,;12.94,3.22,;12.96,4.76,;14.32,2.4,;15.65,3.17,;15.65,4.71,;16.98,2.4,;18.32,3.17,)|
C[C@H]1CNCC[C@H]1Oc1c(C)cc(Cl)cc1-c1ccnc2cc(CN3C(=O)C4C(C3=O)C4(C)C)sc12 |r|
NS(=O)(=O)Nc1ccc(cc1)-c1cn(Cc2cc(cc(c2)-c2ccccc2C(O)=O)C(O)=O)nn1
Nc1ccc(cc1)-c1cn(Cc2cc(cc(c2)-c2ccc(cc2)C(O)=O)C(O)=O)nn1
Nc1ccc(cc1)-c1cn(Cc2cc(cc(c2)-c2cccc(c2)C(O)=O)C(O)=O)nn1
Nc1ccc(cc1)-c1cn(Cc2cc(cc(c2)-c2ccccc2C(O)=O)C(O)=O)nn1
Nc1ccc(cc1)-c1cn(Cc2cccc(c2)-c2ccccc2C(O)=O)nn1
Nc1cccc(c1)-c1cn(Cc2cc(cc(c2)-c2ccccc2C(O)=O)C(O)=O)nn1
OC(=O)c1cc(Cn2cc(nn2)-c2ccc(NCc3ccccc3)cc2)cc(c1)-c1ccccc1C(O)=O
OC(=O)c1cc(Cn2cc(nn2)-c2cccnc2)cc(c1)-c1ccccc1C(O)=O
OC1C\C(=C/c2ccc(cc2)[N+]([O-])=O)C(=O)\C(C1)=C\c1ccc(cc1)[N+]([O-])=O
OC[C@H]1O[C@@H](Oc2c(O)cc3oc4cc(O)c(O)cc4c(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O |r|
[H]C12[#6]-[#6@H]-3-[#6]=[#6]4-[#6](=O)-c5c(-[#8]-[#6](-[#6])=O)c6-[#6]=[#6]C([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#8]-c6c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14C([#6]\[#6]=[#6](/[#6])-[#6](-[#8])=O)([#8]C2([#6])[#6])[#6]-3=O |r,c:15,t:4,TLB:34:35:44.45:48.3.2,4:3:35:44.45,THB:5:35:44.45:48.3.2,49:48:35:44.45,45:1:5.4:36.48|
[O-][N+](=O)c1cc(\C=C2/CCN(C\C(=C/c3ccc(F)c(c3)[N+]([O-])=O)C2=O)C(=O)C=C)ccc1F
[O-][N+](=O)c1ccc(\C=C2/CS(=O)(=O)C\C(=C/c3ccc(cc3)[N+]([O-])=O)C2=O)cc1