103 SMILES Strings for Sortilin
Compound Name
SMILES String
CC(=C)c1ccc(C(=O)Nc2cccc(C)n2)c(c1)C(O)=O
CC(C)CC1=NOC(=O)C1 |t:4|
CC(C)CCC1=NOC(=O)C1 |t:5|
CC(C)CCN1CC(=O)N=N1 |c:9|
CC(C)CCN1N=NC(=O)C1C |c:6|
CC(C)CCN1N=NC(=O)C1C(=O)Nc1cccc(C)n1 |c:6|
CC(C)CCN1N=NC(=O)C1C(=O)Nc1cccnc1 |c:6|
CC(C)CCN1N=NC(=O)C1C(=O)Nc1ccncc1 |c:6|
CC(C)CCN1N=NC(=O)C1C(N)=O |c:6|
CC(C)CCN1N=NC(=O)C1NC(=O)c1cccc(C)n1 |c:6|
CC(C)CCN1N=NC(=O)C1NC(=O)c1cccnc1 |c:6|
CC(C)CCN1N=NC(=O)C1NC(=O)c1ccncc1 |c:6|
CC(C)CCN1N=NC(=O)C1NC(C)=O |c:6|
CC(C)CCc1n[nH]c(=O)o1
CC(C)CCc1noc(=O)[nH]1
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCCN)C(C)(C)C)C(O)=O |w:38.40|
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCCN)C(C)(C)C)C(O)=O |w:36.37|
CC(C)C[C@H](NCc1c(O)ccc2c(C)cc(=O)oc12)C(O)=O |r|
CC(C)c1ccc(C(=O)Nc2cccc(C)n2)c(c1)C(O)=O
CCCc1ccc(C(=O)Nc2cccc(C)n2)c(c1)C(O)=O
CCNC(N)=NCCC[C@H](N)C(=O)NC(N)=NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)=O |w:16.16,5.5|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCCN(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCCNC)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCC[N+](C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCN(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCCNC)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCC[N+](C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCN(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCN)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCN1CCN=C1N)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33,c:48|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCN=C(N)NC)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33,43.44|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCNC)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCCNC1NCCN1)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)NC(=O)[C@@H](N)CCC[N+](C)(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O |w:32.33|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(O)=O)C(O)=O
CNC(=O)C1N(CCC(C)C)N=NC1=O |c:11|
COCc1cccc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)n1
COc1cc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)ccn1
COc1cccc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)n1
COc1cccc(OC)c1-c1cc(nn1-c1ccnc2cc(Cl)ccc12)C(=O)NC1(C2CC3CC(C2)CC1C3)C(O)=O |TLB:38:37:35:31.32.33,39:29:35:31.32.33,28:29:31.38.32:36.34.35,THB:38:32:29.37.36:35,39:29:31.38.32:36.34.35,28:29:35:31.32.33,33:32:29:36.34.35,33:34:29:31.38.32,(-7.63,.4,;-6.3,-.36,;-6.29,-1.9,;-7.62,-2.68,;-7.62,-4.22,;-6.29,-4.99,;-4.95,-4.22,;-3.61,-4.99,;-3.61,-6.53,;-4.95,-2.67,;-3.63,-1.9,;-2.22,-2.52,;-1.19,-1.37,;-1.97,-.04,;-3.47,-.36,;-4.62,.66,;-6.08,.17,;-7.22,1.19,;-6.91,2.71,;-5.45,3.19,;-5.14,4.69,;-3.68,5.16,;-3.37,6.67,;-2.53,4.14,;-2.85,2.64,;-4.31,2.16,;.35,-1.53,;.98,-2.93,;1.24,-.27,;2.78,-.43,;3.43,1.2,;4.84,1.23,;6.02,2.07,;5.46,3.5,;3.95,3.52,;2.87,2.58,;3.44,1.99,;4.02,.52,;5.54,.51,;3.42,-1.84,;2.51,-3.09,;4.95,-2,)|
Cc1cc(C)nc(NC(=O)c2ccc(Br)cc2C(O)=O)c1
Cc1cc(NC(=O)c2cc(Cl)c(Cl)cc2C(O)=O)ccn1
Cc1cc(NC(=O)c2ccc(Br)cc2C(O)=O)ccn1
Cc1cc(NC(=O)c2ccc(Br)cc2C(O)=O)ncn1
Cc1cc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)cc(C)n1
Cc1cc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)ccn1
Cc1ccc(C(=O)Nc2cccc(C)n2)c(c1)C(O)=O
Cc1ccc(NC(=O)c2cc(Cl)c(Cl)cc2C(O)=O)nc1C
Cc1ccc(NC(=O)c2cc(c(cc2C(O)=O)C(F)(F)F)C(F)(F)F)nc1C
Cc1ccc(NC(=O)c2ccc(Br)cc2C(O)=O)cn1
Cc1ccc(NC(=O)c2ccc(Br)cc2C(O)=O)nc1
Cc1ccc(NC(=O)c2ccc(Br)cc2C(O)=O)nc1C
Cc1ccc(NC(=O)c2ccc(Br)cc2C(O)=O)nn1
Cc1ccc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)nc1C
Cc1ccc(cc1)S(=O)(=O)N1CCCN(Cc2ccccc2)CCCN(CC(=C)C1)S(=O)(=O)c1ccc(C)cc1
Cc1cccc(NC(=O)c2cc(Br)ccc2C(O)=O)n1
Cc1cccc(NC(=O)c2cc(C)c(C)cc2C(O)=O)n1
Cc1cccc(NC(=O)c2cc(Cl)c(Cl)cc2C(O)=O)n1
Cc1cccc(NC(=O)c2cc(c(cc2C(O)=O)C(F)(F)F)C(F)(F)F)n1
Cc1cccc(NC(=O)c2cc(ccc2C(O)=O)C(F)(F)F)n1
Cc1cccc(NC(=O)c2ccc(Br)cc2C(O)=O)c1
Cc1cccc(NC(=O)c2ccc(Br)cc2C(O)=O)n1
Cc1cccc(NC(=O)c2ccc(Cl)c(F)c2C(O)=O)n1
Cc1cccc(NC(=O)c2ccc(Cl)cc2C(O)=O)n1
Cc1cccc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)n1
Cc1cccc(NC(=O)c2ccc(cc2C(O)=O)[N+]([O-])=O)n1
Cc1cccnc1NC(=O)c1ccc(Br)cc1C(O)=O
Cc1ccnc(NC(=O)c2cc(Cl)c(Cl)cc2C(O)=O)c1
Cc1ccnc(NC(=O)c2ccc(Br)cc2C(O)=O)c1
Cc1ccnc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)c1
Cc1ccnc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)n1
Cc1cnc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)nc1C
Cc1csc(NC(=O)c2ccc(Br)cc2C(O)=O)n1
Cc1ncc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)nc1C
Cc1nccc(NC(=O)c2cc(Cl)c(Cl)cc2C(O)=O)n1
Cc1nccc(NC(=O)c2cc(c(cc2C(O)=O)C(F)(F)F)C(F)(F)F)n1
Cc1nccc(NC(=O)c2ccc(Br)cc2C(O)=O)n1
Cc1nccc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)n1
O=C1CC(=NO1)c1ccccc1 |c:3|
O=C1CC(Cc2ccccc2)=NO1 |c:11|
O=C1CN(Cc2ccccc2)N=N1 |c:12|
O=c1[nH]nc(o1)-c1ccccc1
OC(=O)c1cc(Br)ccc1C(=O)Nc1ccc(Cl)c(Cl)n1
OC(=O)c1cc(Br)ccc1C(=O)Nc1ccc(Cl)cn1
OC(=O)c1cc(Br)ccc1C(=O)Nc1ccc2ccccc2n1
OC(=O)c1cc(Br)ccc1C(=O)Nc1cccc(Cl)n1
OC(=O)c1cc(Br)ccc1C(=O)Nc1ccccn1
OC(=O)c1cc(Br)ccc1C(=O)Nc1cccnc1
OC(=O)c1cc(Br)ccc1C(=O)Nc1sc2CCCCc2c1C#N
OC(=O)c1cc(Br)ccc1C(=O)Nc1sc2CCCCc2c1[N+]#[C-]
OC(=O)c1cc(c(cc1C(=O)Nc1ccc2CCCCc2n1)C(F)(F)F)C(F)(F)F
OC(=O)c1cc(ccc1C(=O)NCc1ccccn1)C(F)(F)F
OC(=O)c1cc(ccc1C(=O)NCc1cccnc1)C(F)(F)F
OC(=O)c1cc(ccc1C(=O)NCc1ccncc1)C(F)(F)F
OC(=O)c1cc(ccc1C(=O)Nc1ccc2CCCCc2n1)C(F)(F)F
OC(=O)c1cc(ccc1C(=O)Nc1ccc2CCOCc2n1)C(F)(F)F
OC(=O)c1cc(ccc1C(=O)Nc1ncc(cc1Cl)C(F)(F)F)C(F)(F)F
OCc1cccc(NC(=O)c2ccc(cc2C(O)=O)C(F)(F)F)n1
[#6]-[#6]-[#6@@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r|
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]-[#7]=[#6](-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |w:32.33|
[#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6](=O)-[#7]-1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](-[#8])=O |r|