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Name:CHEMBL413617
PubChem ID:44368236
Pathway:Show KEGG pathways
InChI:InChI=1S/C56H67N9O11S2/c1-33(66)48-55(74)63-45(28-35-15-6-3-7-16-35)53(72)64-47(56(75)76)32-78-77-31-41(58)49(68)60-43(27-34-13-4-2-5-14-34)51(70)61-44(29-36-22-24-39(67)25-23-36)52(71)62-46(30-38-19-12-18-37-17-8-9-20-40(37)38)54(73)59-42(50(69)65-48)21-10-11-26-57/h2-9,12-20,22-25,33,41-48,66-67H,10-11,21,26-32,57-58H2,1H3,(H,59,73)(H,60,68)(H,61,70)(H,62,71)(H,63,74)(H,64,72)(H,65,69)(H,75,76)/t33-,41-,42+,43-,44+,45+,46?,47-,48?/m1/s1
SMILES:NCCCC[C@@H]1NC(=O)C(NC(=O)[C@H](Cc2ccc(cc2)O)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)Cc1cccc2c1cccc2

Properties:
Formula:C56H67N9O11S2Atoms:78
Molecular Weight:1106.31Rotatable Bonds:14
H-bond Acceptors:22H-bond Donors:12
logP:5.2285
Targets:
Synonyms:
CHEBI:354251
CHEMBL413617