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Drug Details

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Name:CHEMBL1089290
PubChem ID:46830194
Pathway:Show KEGG pathways
InChI:InChI=1S/C33H47F3N6O4S2/c1-48(45,46)40-17-11-29-27(23-40)32(24-7-8-28(33(34,35)36)30(20-24)47-19-18-38-12-3-2-4-13-38)37-42(29)22-26(43)21-39-15-9-25(10-16-39)41-14-5-6-31(41)44/h7-8,20,25-26,43H,2-6,9-19,21-23H2,1H3
SMILES:OC(Cn1nc(c2c1CCN(C2)S(=O)(=O)C)c1ccc(c(c1)SCCN1CCCCC1)C(F)(F)F)CN1CCC(CC1)N1CCCC1=O

Properties:
Formula:C33H47F3N6O4S2Atoms:48
Molecular Weight:712.889Rotatable Bonds:12
H-bond Acceptors:11H-bond Donors:1
logP:4.7447
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720414
CHEMBL1089290