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Drug Details

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Name:CHEMBL329100
PubChem ID:44327494
Pathway:Show KEGG pathways
InChI:InChI=1S/C44H51N7O10S2/c1-4-24(2)37-42(58)49-34(41(57)48-32(44(60)61)19-28-21-45-30-18-12-11-17-29(28)30)23-63-62-22-33(40(56)47-31(20-35(53)54)39(55)51-37)50-43(59)38(46-25(3)52)36(26-13-7-5-8-14-26)27-15-9-6-10-16-27/h5-18,21,24,31-34,36-38,45H,4,19-20,22-23H2,1-3H3,(H,46,52)(H,47,56)(H,48,57)(H,49,58)(H,50,59)(H,51,55)(H,53,54)(H,60,61)/t24-,31+,32-,33+,34-,37?,38?/m0/s1
SMILES:CC[C@@H]([C@@H]1NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](CSSC[C@H](NC1=O)C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)C(C(c1ccccc1)c1ccccc1)NC(=O)C)C

Properties:
Formula:C44H51N7O10S2Atoms:63
Molecular Weight:902.047Rotatable Bonds:18
H-bond Acceptors:18H-bond Donors:9
logP:4.6307
Targets:
Synonyms:
CHEBI:254877
CHEMBL329100