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Drug Details

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Name:CHEMBL1093951
PubChem ID:25102980
Pathway:Show KEGG pathways
InChI:InChI=1S/C35H45F3N6O3S2/c1-49(46,47)42-21-14-31-29(25-42)34(40-44(31)18-6-16-41-19-12-28(13-20-41)43-17-5-9-33(43)45)27-10-11-30(35(36,37)38)32(23-27)48-22-15-39-24-26-7-3-2-4-8-26/h2-4,7-8,10-11,23,28,39H,5-6,9,12-22,24-25H2,1H3
SMILES:O=C1CCCN1C1CCN(CC1)CCCn1nc(c2c1CCN(C2)S(=O)(=O)C)c1ccc(c(c1)SCCNCc1ccccc1)C(F)(F)F

Properties:
Formula:C35H45F3N6O3S2Atoms:49
Molecular Weight:718.895Rotatable Bonds:14
H-bond Acceptors:10H-bond Donors:1
logP:6.5308
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720303
CHEMBL1093951