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Drug Details

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Name:CHEMBL1085728
PubChem ID:46891069
Pathway:Show KEGG pathways
InChI:InChI=1S/C33H41N3O9/c1-3-44-29(38)19-34-33(42)30(39)28(21-43-20-24-12-8-5-9-13-24)36-32(41)27(18-23-10-6-4-7-11-23)35-31(40)25-14-16-26(17-15-25)45-22(2)37/h5,8-9,12-17,23,27-28H,3-4,6-7,10-11,18-21H2,1-2H3,(H,34,42)(H,35,40)(H,36,41)/t27-,28?/m0/s1
SMILES:CCOC(=O)CNC(=O)C(=O)C(NC(=O)[C@@H](NC(=O)c1ccc(cc1)OC(=O)C)CC1CCCCC1)COCc1ccccc1

Properties:
Formula:C33H41N3O9Atoms:45
Molecular Weight:623.693Rotatable Bonds:21
H-bond Acceptors:12H-bond Donors:3
logP:3.8034
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:733151
CHEMBL1085728