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Name:CHEMBL367125
PubChem ID:44388049
Pathway:Show KEGG pathways
InChI:InChI=1S/C45H57N9O9S2/c1-26(55)38-44(61)52-35(21-28-14-6-3-7-15-28)42(59)53-37(45(62)63)25-65-64-24-31(47)39(56)50-34(20-27-12-4-2-5-13-27)41(58)51-36(22-29-23-48-32-17-9-8-16-30(29)32)43(60)49-33(40(57)54-38)18-10-11-19-46/h2-9,12-17,23,26,31,33-38,48,55H,10-11,18-22,24-25,46-47H2,1H3,(H,49,60)(H,50,56)(H,51,58)(H,52,61)(H,53,59)(H,54,57)(H,62,63)/t26-,31-,33+,34+,35+,36+,37+,38?/m1/s1
SMILES:NCCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](N)CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC1=O)[C@H](O)C)Cc1ccccc1)C(=O)O)Cc1c[nH]c2c1cccc2

Properties:
Formula:C45H57N9O9S2Atoms:65
Molecular Weight:932.119Rotatable Bonds:12
H-bond Acceptors:19H-bond Donors:11
logP:3.7947
Targets:
Synonyms:
CHEBI:397836
CHEMBL367125