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Drug Details

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Name:CHEMBL1090989
PubChem ID:46884491
Pathway:Show KEGG pathways
InChI:InChI=1S/C32H39F3N6O3S/c33-32(34,35)26-5-4-23(17-29(26)45-21-30(43)40-13-15-44-16-14-40)31-25-18-36-10-6-28(25)41(38-31)20-24(42)19-39-11-7-22(8-12-39)27-3-1-2-9-37-27/h1-5,9,17,22,24,36,42H,6-8,10-16,18-21H2
SMILES:OC(Cn1nc(c2c1CCNC2)c1ccc(c(c1)SCC(=O)N1CCOCC1)C(F)(F)F)CN1CCC(CC1)c1ccccn1

Properties:
Formula:C32H39F3N6O3SAtoms:45
Molecular Weight:644.751Rotatable Bonds:11
H-bond Acceptors:10H-bond Donors:2
logP:4.0056
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720734
CHEMBL1090989