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Drug Details

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Name:CHEMBL1089278
PubChem ID:25104663
Pathway:Show KEGG pathways
InChI:InChI=1S/C36H45F3N6O5S2/c1-52(49,50)43-18-13-31-29(24-43)35(41-45(31)23-28(46)22-42-16-11-27(12-17-42)44-15-5-8-34(44)48)26-9-10-30(36(37,38)39)32(21-26)51-19-14-40-33(47)20-25-6-3-2-4-7-25/h2-4,6-7,9-10,21,27-28,46H,5,8,11-20,22-24H2,1H3,(H,40,47)
SMILES:OC(Cn1nc(c2c1CCN(C2)S(=O)(=O)C)c1ccc(c(c1)SCCNC(=O)Cc1ccccc1)C(F)(F)F)CN1CCC(CC1)N1CCCC1=O

Properties:
Formula:C36H45F3N6O5S2Atoms:52
Molecular Weight:762.905Rotatable Bonds:15
H-bond Acceptors:12H-bond Donors:2
logP:5.0707
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720401
CHEMBL1089278