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Drug Details

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Name:CHEMBL1089276
PubChem ID:25104665
Pathway:Show KEGG pathways
InChI:InChI=1S/C35H43F3N6O6S2/c1-52(49,50)42-17-12-30-28(22-42)33(40-44(30)21-27(46)20-41-15-10-25(11-16-41)43-14-2-3-32(43)47)24-6-9-29(35(36,37)38)31(19-24)51-18-13-39-34(48)23-4-7-26(45)8-5-23/h4-9,19,25,27,45-46H,2-3,10-18,20-22H2,1H3,(H,39,48)
SMILES:OC(Cn1nc(c2c1CCN(C2)S(=O)(=O)C)c1ccc(c(c1)SCCNC(=O)c1ccc(cc1)O)C(F)(F)F)CN1CCC(CC1)N1CCCC1=O

Properties:
Formula:C35H43F3N6O6S2Atoms:52
Molecular Weight:764.878Rotatable Bonds:14
H-bond Acceptors:13H-bond Donors:3
logP:4.8474
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720398
CHEMBL1089276