Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:CHEMBL1090995
PubChem ID:46884497
Pathway:Show KEGG pathways
InChI:InChI=1S/C31H40F3N7O5S2/c1-21-35-30(46-37-21)22-6-11-38(12-7-22)9-3-10-41-26-8-13-40(48(2,43)44)19-24(26)29(36-41)23-4-5-25(31(32,33)34)27(18-23)47-20-28(42)39-14-16-45-17-15-39/h4-5,18,22H,3,6-17,19-20H2,1-2H3
SMILES:O=C(N1CCOCC1)CSc1cc(ccc1C(F)(F)F)c1nn(c2c1CN(CC2)S(=O)(=O)C)CCCN1CCC(CC1)c1onc(n1)C

Properties:
Formula:C31H40F3N7O5S2Atoms:48
Molecular Weight:711.818Rotatable Bonds:12
H-bond Acceptors:13H-bond Donors:0
logP:4.6931
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720740
CHEMBL1090995