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Drug Details

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Name:CHEMBL1090990
PubChem ID:46884492
Pathway:Show KEGG pathways
InChI:InChI=1S/C33H41F3N6O5S2/c1-49(46,47)41-15-10-29-26(20-41)32(38-42(29)19-25(44)17-39-12-7-22(8-13-39)28-4-2-3-11-37-28)23-5-6-27(33(34,35)36)30(16-23)48-21-31(45)40-14-9-24(43)18-40/h2-6,11,16,22,24-25,43-44H,7-10,12-15,17-21H2,1H3/t24-,25?/m0/s1
SMILES:OC(Cn1nc(c2c1CCN(C2)S(=O)(=O)C)c1ccc(c(c1)SCC(=O)N1CC[C@@H](C1)O)C(F)(F)F)CN1CCC(CC1)c1ccccn1

Properties:
Formula:C33H41F3N6O5S2Atoms:49
Molecular Weight:722.841Rotatable Bonds:12
H-bond Acceptors:12H-bond Donors:2
logP:4.1019
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720735
CHEMBL1090990