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

Drug Details

add
Name:CHEMBL1089621
PubChem ID:46884393
Pathway:Show KEGG pathways
InChI:InChI=1S/C30H40F4N6O3S/c31-21-6-11-37(12-7-21)14-15-44-26-16-20(4-5-24(26)30(32,33)34)27-23-19-39(29(43)28(35)42)13-8-25(23)40(36-27)18-22(41)17-38-9-2-1-3-10-38/h4-5,16,21-22,41H,1-3,6-15,17-19H2,(H2,35,42)/t22-/m0/s1
SMILES:O[C@H](Cn1nc(c2c1CCN(C2)C(=O)C(=O)N)c1ccc(c(c1)SCCN1CCC(CC1)F)C(F)(F)F)CN1CCCCC1

Properties:
Formula:C30H40F4N6O3SAtoms:44
Molecular Weight:640.736Rotatable Bonds:12
H-bond Acceptors:10H-bond Donors:2
logP:3.8257
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720496
CHEMBL1089621