150 SMILES Strings for Transcription factor Jun

Compound Name
SMILES String
COc1ccc(OC)c(\C=C\C(=O)\C=C\c2cc(OC)ccc2OC)c1
O=C(\C=C\c1cccnc1)/C=C/c1cccnc1
COc1cc(\C=C\C(\O)=C(/Cc2ccccc2)C(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
COc1cc(\C=C\C(\O)=C(/C)C(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
COc1cc(\C=C2/CCC\C(=C/c3ccc(O)c(OC)c3)C2=O)ccc1O
O=C(\C=C\c1ccncc1)/C=C/c1ccncc1
COc1cc(\C=C\C(=O)\C=C\c2ccc(OC(C)=O)c(OC)c2)ccc1OC(C)=O
Oc1ccccc1\C=C\C(=O)\C=C\c1ccccc1O
COc1cc(\C=C\C(\O)=C\C(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O
CCCc1nc(Cl)ncc1C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Cc1ncc(C(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c(n1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2nnc(Cl)cc2C(F)(F)F)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(nc2)-c2ccccc2)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cc(Cl)nc(Cl)n2)cc(c1)C(F)(F)F
Fc1ncc(C(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c(n1)C(F)(F)F
Cc1nc(Cl)ncc1C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)nc2C(F)(F)F)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(nc2)C(F)(F)F)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)nc2-c2ccccc2)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)nc2Cl)cc(c1)C(F)(F)F
CCc1nc(Cl)ncc1C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(nc2C(F)(F)F)C#N)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2ccc(Cl)nn2)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)nc2-c2cccs2)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(nc2Cl)C(F)(F)F)cc(c1)C(F)(F)F
Cc1nc(ncc1C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(nc2C(F)(F)F)C(F)(F)F)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)nc2C(F)(F)C(F)(F)F)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)cn2)cc(c1)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cc(nc(Cl)n2)C(F)(F)F)cc(c1)C(F)(F)F
Cc1cc(nc(Cl)n1)C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
FC(F)(F)c1cc(NC(=O)c2cnc(Cl)nc2)cc(c1)C(F)(F)F
Cc1nc(Cl)ncc1C(=O)Nc1cc(Cl)cc(Cl)c1
CNc1nc(C)c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1C |(32.14,-.5,;31.37,.83,;29.84,.83,;29.07,-.51,;27.56,-.19,;26.42,-1.22,;27.4,1.34,;28.8,1.97,;26.07,2.11,;24.72,1.33,;23.38,2.1,;22.04,1.33,;20.71,2.1,;20.71,3.65,;22.04,4.42,;23.38,3.65,;24.71,4.44,;24.7,5.98,;26.06,3.66,;27.39,4.44,;28.73,3.67,;30.06,4.44,;30.05,5.98,;28.71,6.75,;27.38,5.97,;26.05,6.73,)|
Cc1nc(Nc2ccccc2)sc1-c1nc2ccccc2c(=O)n1-c1ccccc1C |(-4.16,-12.94,;-3.02,-11.9,;-1.51,-12.22,;-.75,-10.89,;.79,-10.88,;1.56,-12.21,;.79,-13.55,;1.57,-14.87,;3.11,-14.87,;3.87,-13.52,;3.09,-12.2,;-1.78,-9.74,;-3.18,-10.37,;-4.51,-9.6,;-5.86,-10.38,;-7.2,-9.61,;-8.54,-10.38,;-9.87,-9.61,;-9.87,-8.06,;-8.54,-7.29,;-7.21,-8.06,;-5.87,-7.27,;-5.88,-5.73,;-4.52,-8.05,;-3.19,-7.27,;-1.86,-8.04,;-.52,-7.27,;-.53,-5.73,;-1.87,-4.96,;-3.2,-5.74,;-4.54,-4.98,)|
CNc1nc(C)c(s1)-c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
Cc1nc(Nc2ccc(Cl)cc2)sc1-c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
CNc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1OC)-c1ccccc1 |(13.7,-39.27,;12.89,-37.97,;11.35,-38.01,;10.49,-39.29,;9.01,-38.86,;8.96,-37.31,;10.41,-36.8,;7.62,-36.55,;6.29,-37.32,;4.95,-36.56,;3.61,-37.33,;2.28,-36.56,;2.28,-35.02,;3.61,-34.25,;4.95,-35.01,;6.27,-34.23,;6.27,-32.69,;7.62,-35,;8.95,-34.23,;10.28,-35,;11.61,-34.22,;11.61,-32.68,;10.26,-31.92,;8.94,-32.69,;7.6,-31.93,;7.59,-30.39,;7.79,-39.8,;6.37,-39.21,;5.15,-40.15,;5.36,-41.68,;6.79,-42.26,;8,-41.32,)|
CC(=O)c1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1cc(c(s1)N1CCOCC1)-c1ccncc1
CC(C)C[C@@H]1NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CSSC[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC1=O)C(N)=O)NC(C)=O |r|
CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1
CCCc1c(C(O)=O)c(O)cc2C(=O)c3cccc(O)c3C(=O)c12
CC[C@](C)(O)C(=O)O[C@@H]1[C@H]2[C@@H](C)[C@@H](O)[C@]3(O)OC[C@@]22[C@H]3[C@]3(C)[C@@H](C[C@H]2OC1=O)C(C)CC(=O)C3=O |r,TLB:11:10:19:17.16,8:9:19:17.16,13:12:19:17.16|
COC1=C(C)[C@@H]2CC(=O)O[C@@H]3C[C@H]4[C@H](C)[C@@H](O)[C@H](O)C(=O)[C@]4(C)[C@@H](C1=O)[C@]23C |r,c:2|
CC(C)c1oc(=O)cc2c1C(O)C1OC(=O)C3(C)C1C2(C)C1OC1C3O
CC(C)[C@H]1OC(=O)C=C2[C@@]11O[C@@H]1[C@H]1OC(=O)[C@]3(C)[C@H]1[C@]2(C)[C@@H]1O[C@@H]1[C@@H]3O |r,c:7|
[H][C@@]12C(C)=C[C@@](O)(C(=O)O\C=C(/C(O)=O)c3ccc(O)c(OC)c3)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)OC |r,c:3,44|
[H][C@@]12O[C@]1([H])[C@](O)(C(=O)O\C=C(/C(O)=O)c1ccc(O)c(OC)c1)[C@@]1([H])[C@H](O[C@]3([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)OC)[C@@]21[H] |r,t:44|
OC(=O)CCc1cc(ccc1OCc1ccc2c(O)noc2c1)C(=O)c1ccc(OC2CCCC2)cc1O
COc1ccc2nc(nc(NN3C(=O)C=C(C)C3=O)c2c1)-c1cccs1 |t:14|
COc1cccc2nc(nc(NN3C(=O)C=C(C)C3=O)c12)-c1cccs1 |t:15|
CCOC(=O)c1cnc(nc1NN1C(=O)C=C(C)C1=O)-c1cccs1 |t:16|
CCOC(=O)c1cnc(nc1NN1C(=O)C=C(C)C1=O)-c1ccccc1 |t:16|
CCOC(=O)c1cnc(nc1NN1C(=O)C=C(C)C1=O)C(F)(F)F |t:16|
CC1=CC(=O)N(Nc2ncc(-c3coc(C)n3)c(n2)-c2cccs2)C1=O |t:1|
CCc1nc(NN2C(=O)C=C(C)C2=O)ncc1-c1coc(C)n1 |t:9|
CC1=CC(=O)N(Nc2ncc(C(=O)c3ccccc3)c(n2)C(F)(F)F)C1=O |t:1|
CC(=O)c1cnc(NN2C(=O)C=C(C)C2=O)nc1C(F)(F)F |t:11|
CC1=CC(=O)N(Nc2ncc(C(=O)OC(C)(C)C)c(n2)C(F)(F)F)C1=O |t:1|
CCOC(=O)c1cnc(NN2C(=O)C=C(C)C2=O)nc1-c1ccc(C)s1 |t:13|
CCOC(=O)c1cnc(nc1CC)N(C)N1C(=O)C=C(C)C1=O |t:19|
CCOC(=O)c1cnc(NN2C(=O)C=C(C)C2=O)nc1CC |t:13|
CCOC(=O)c1cnc(nc1C(F)(F)F)N(C)N1C(=O)C=C(C)C1=O |t:21|
CCOC(=O)c1cnc(NN2C(=O)C=C(C)C2=O)nc1C(F)(F)F |t:13|
FC(F)(F)c1ccc2Sc3nc(Cl)ncc3C(=O)Nc2c1
FC(F)(F)c1ccc2Oc3nc(Cl)ncc3C(=O)Nc2c1
FC(F)(F)c1ccc2Nc3nc(Cl)ncc3C(=O)Nc2c1
FC(F)(F)c1ccc2Cc3nc(Cl)ncc3C(=O)Nc2c1
FC(F)(F)c1ccc2c(c1)[nH]c(=O)c1cnc(Cl)nc21
FC(F)(F)c1cc(CN2C(=O)c3cnc(Cl)nc3C2=O)cc(c1)C(F)(F)F
FC(F)(F)c1cc(cc(c1)C(F)(F)F)N1C(=O)c2cnc(Cl)nc2C1=O
FC(F)(F)c1ccc2COCN(C(=O)c3cnc(Cl)nc3C(F)(F)F)c2c1
Cc1cc(nc(Cl)n1)C(=O)Nc1ccc(cc1C(F)(F)F)C(F)(F)F
FC(F)(F)c1ccc(NC(=O)c2cc(nc(Cl)n2)C(F)(F)F)c(c1)C(F)(F)F
CCOc1nc(cc(N)c1C#N)C(=O)NCc1ccc(cc1)S(C)(=O)=O
CCNC(=O)N1CCC(CC1)Nc1nccc(n1)-n1ccc2ccccc12
CCNC(=O)N1CC(C1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1nccc(n1)-c1cnc2ccccn12
CN1CCN(CC1)C(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-n1ccc2ccccc12
CN(C)C(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC[C@H](C1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1nccc(n1)-c1c[nH]c2ccccc12
CNC(=O)CN1CCC[C@@H](C1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1nccc(n1)-c1c([nH]c2ccccc12)C(C)C
CNCC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1ncc(C#N)c(n1)-c1c[nH]c2cc(F)ccc12
CC1CCN(CC1)NC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1nccc(n1)-c1c([nH]c2ccccc12)-c1ccccc1
CC1CCN(CC1)C(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1ncc(C)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1cnc2ccccn12
CNC(=O)CN1CCC[C@H](C1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CNC(=O)CN1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(C1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12 |w:8.10|
CN(C)CC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CC(=O)NCC(=O)N1CCC(CC1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
CCNC(=O)N1CCC[C@@H](C1)Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12
COc1ccc2c3[C@@H](O)[C@@H]4CCC[N+]4([O-])Cc3c3cc(OC)c(OC)cc3c2c1 |w:13.14|
COc1cc2c3CN4CCC[C@H]4[C@@H](O)c3c3ccc(O)cc3c2cc1OC
COc1cc2c3CN4CCC[C@H]4[C@H](O)c3c3cc(OC)c(OC)cc3c2cc1OC
COc1cc2C3CN4CCC[C@H]4C=C3c3cc(OC)c(OC)cc3-c2cc1OC |w:5.5,c:13|
COc1cc2c3CN4CCC[C@H]4[C@@H](O)c3c3cc(OC)c(OC)cc3c2cc1OC
COc1ccc2c3[C@H](O)[C@@H]4CCCN4Cc3c3cc(OC)c(O)cc3c2c1
COc1ccc2c3[C@H](O)[C@@H]4CCC[N+]4([O-])Cc3c3cc(OC)c(O)cc3c2c1 |w:13.14|
COc1cc2c3[C@H](O)[C@@H]4CCCN4Cc3c3cc(OC)c(OC)cc3c2cc1O
COc1ccc2c3[C@@H](O)[C@@H]4CCCN4Cc3c3cc(OC)c(OC)cc3c2c1
COc1ccc2c3C[C@H]4CCCN4Cc3c3cc(OC)c(O)cc3c2c1
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(N)=O |r|
CCOC(=O)Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1)-c1ccccc1
COc1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1sc(Nc2ccc(Cl)cc2)nc1-c1ccccc1
CCOC(=O)Nc1nc(C)c(s1)-c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
CNc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1)-c1ccccc1
Clc1ccc(Nc2nc(c(s2)-c2nc3ccccc3c(=O)n2-c2ccc(Cl)cc2)-c2ccccc2)cc1
Cn1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc2c1
C1CN(CCO1)c1ncn(n1)-c1ccc(Nc2ncc3ccc(cc3n2)-c2cn[nH]c2)cc1
Cc1ccc(cn1)-c1ncn(n1)-c1ccc(Nc2ncc3ccc(cc3n2)-c2cn[nH]c2)cc1
Cn1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)-c3ccccn3)nc2c1
Cc1ccc(cn1)-c1cccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc12
Cn1cc(cn1)-c1cccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc12
COc1ccc(cc1F)-c1cccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc12
C1CN(CCO1)c1ncn(n1)-c1ccc(Nc2ncc3cccc(-c4nccs4)c3n2)cc1
C1CN(CCO1)c1ncn(n1)-c1ccc(Nc2ncc3cccc(-c4ccccc4)c3n2)cc1
COc1ccc(cc1F)-c1cccc2cnc(Nc3ccc(cc3)-n3cnc(C)n3)nc12
Cc1ncn(n1)-c1ccc(Nc2ncc3cccc(-c4nccs4)c3n2)cc1
COc1ccc(cc1F)-c1cccc2cnc(Nc3ccc(cc3)-n3cnc(n3)-c3ccccn3)nc12
Cc1ccc(cn1)-c1cccc2cnc(Nc3ccc4OCOc4c3)nc12
Cc1ccc(cn1)-c1cccc2cnc(NC3CCC(O)CC3)nc12 |(-2.41,-16.62,;-3.75,-17.39,;-3.76,-18.93,;-5.09,-19.69,;-6.42,-18.91,;-6.42,-17.38,;-5.08,-16.61,;-7.75,-19.68,;-9.09,-18.9,;-10.42,-19.68,;-10.42,-21.22,;-9.09,-21.99,;-9.11,-23.53,;-7.78,-24.31,;-6.43,-23.55,;-5.1,-24.33,;-3.77,-23.57,;-2.44,-24.35,;-1.11,-23.6,;-1.08,-22.06,;.26,-21.31,;-2.41,-21.28,;-3.76,-22.03,;-6.42,-22,;-7.75,-21.22,)|
Cc1ccc(cn1)-c1cccc2cnc(N[C@H]3CC[C@H](CC3)C(=O)N3CCCC3)nc12 |r,wU:16.16,19.23,(12,-17.01,;10.66,-17.78,;10.65,-19.32,;9.32,-20.08,;7.99,-19.31,;7.99,-17.77,;9.33,-17,;6.66,-20.07,;5.32,-19.29,;3.99,-20.07,;3.99,-21.62,;5.32,-22.38,;5.3,-23.92,;6.64,-24.71,;7.98,-23.94,;9.31,-24.72,;10.65,-23.97,;10.65,-22.42,;12,-21.67,;13.33,-22.46,;13.31,-24,;11.97,-24.75,;14.67,-21.7,;14.69,-20.16,;16,-22.49,;15.98,-24.02,;17.44,-24.52,;18.36,-23.28,;17.47,-22.03,;8,-22.39,;6.66,-21.62,)|
Cn1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc2c1Cl
CC(C)n1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc2c1Cl
Cc1c(ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc12)-c1cnn(C)c1
Cn1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc2c1C1CC1
Cn1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc2c1-c1cnn(C)c1
Cn1cc(cn1)-c1ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc2c1-c1ccccc1
COc1c(ccc2cnc(Nc3ccc(cc3)-n3cnc(n3)N3CCOCC3)nc12)-c1cnn(C)c1
CC(C)[C@H]1OC(=O)C=C2C1=C[C@H]1OC(=O)[C@@]3(C)CCC[C@@]2(C)[C@@H]13 |r,c:7,t:10|
NC(=O)c1ccsc1NC(=O)Cc1csc2ccccc12
CC[C@H]1NC(=O)[C@@H]2CSC(=N2)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc2ccccc2)OC(=O)[C@H](C)[C@@H](C)NC(=O)[C@H](NC(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CSC1=N2)C(C)C |r,c:9,t:81|
CC(C)[C@H]1NC(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CSC(=N2)[C@@H](C)NC(=O)[C@@H]2CSC(=N2)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc2ccccc2)OC(=O)[C@H](C)[C@@H](C)NC1=O |r,c:23,34|
Nc1ccc(SC(=N)C(C#N)c2ccccc2C(F)(F)F)cc1
[#6]-[#6@H]-1-[#6@@H](-[#8])[C@@]2([#8])[#8]-[#6][C@]34[#6@H]2[C@@]2([#6])[#6@H](-[#8])-[#6@@H](-[#8])-[#6]=[#6](-[#6])-[#6@@H]2-[#6@@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6@H]3-[#8]-[#6](=O)-[#6]-[#6@@H]-14 |r,t:17,TLB:3:2:9:6.7,0:1:9:6.7,32:33:9:6.7|
CCC(C)C(=O)O[C@@H]1[C@H]2[C@@H](C)[C@@H](O)[C@@]3(O)OC[C@@]22[C@H]3[C@]3(C)[C@@H](C[C@H]2OC1=O)C(C)CC(=O)C3=O |r,TLB:12:11:18:16.15,10:9:18:16.15,7:8:18:16.15|
c1cc(c(cc1C[C@H](C(=O)O)OC(=O)/C=C/c2ccc(c(c2)O)O)O)O
OC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)C1C(C(=Cc2ccc(O)c(O)c12)C(=O)O[C@H](Cc1ccc(O)c(O)c1)C(O)=O)c1ccc(O)c(O)c1 |r,c:19|
OC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)[C@H]1[C@@H]([C@@H]([C@H]1c1ccc(O)c(O)c1)c1ccc(O)c(O)c1)C(=O)O[C@H](Cc1ccc(O)c(O)c1)C(O)=O |r|
OC(C(\C(=C\c1ccc(O)c(O)c1)C(O)=O)c1ccc(O)c(O)c1)C(O)=O
CO[C@@H](CC\C=C/CCCCC(=O)CCCCCCC(=O)CC\C=C/CCCCCCO)C(=O)NCCc1ccc(O)cc1 |r|