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Drug Details

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Name:CHEMBL306771
PubChem ID:44312201
Pathway:Show KEGG pathways
InChI:InChI=1S/C43H65N11O10S2/c1-43(2)35(46)42(64)53-30(21-26-14-16-27(56)17-15-26)37(59)48-22-34(57)49-32(23-55)40(62)52-31(20-25-10-4-3-5-11-25)39(61)54-33(24-65-66-43)41(63)51-29(13-7-9-19-45)38(60)50-28(36(47)58)12-6-8-18-44/h3-5,10-11,14-17,28-33,35,55-56H,6-9,12-13,18-24,44-46H2,1-2H3,(H2,47,58)(H,48,59)(H,49,57)(H,50,60)(H,51,63)(H,52,62)(H,53,64)(H,54,61)/t28-,29-,30-,31+,32-,33+,35+/m0/s1
SMILES:NCCCC[C@@H](C(=O)N[C@H](C(=O)N)CCCCN)NC(=O)[C@H]1CSSC(C)(C)[C@H](N)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)Cc1ccccc1)CO

Properties:
Formula:C43H65N11O10S2Atoms:66
Molecular Weight:960.174Rotatable Bonds:20
H-bond Acceptors:23H-bond Donors:13
logP:2.6659
Targets:
Synonyms:
CHEBI:215681
CHEMBL306771