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Inhibitor Report for: CHEMBL4451596

IC50 19 nM


General
Type Sulfonamide, Pyridine, Trifluoro
Chemical_Nomenclature N-cyclopentyl-2-[4-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-sulfonamide
Canonical SMILES C1CCC(C1)NS(=O)(=O)C2=C3C(=NC=C2)N=C(N3)C4=CC=C(C=C4)C(F)(F)F
InChI InChI=1S/C18H17F3N4O2S/c19-18(20,21)12-7-5-11(6-8-12)16-23-15-14(9-10-22-17(15)24-16)28(26,27)25-13-3-1-2-4-13/h5-10,13,25H,1-4H2,(H,22,23,24)
InChIKey JBHHWVFQIGPHPU-UHFFFAOYSA-N
Other name(s) BDBM50534967 ; Q27455666 ; 5DQ
________________________________________________________________________________________________
MW|410.4
Formula|C18H17F3N4O2S
CAS_number|
PubChem|91754984
UniChem|JBHHWVFQIGPHPU-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | CHEMBL4451596 ligand of proteins in family: Epoxide_hydrolase
Stucture | 1 structure: 5ALS: ligand complex structure of soluble epoxide hydrolase
Protein | human-EPHX2

References:
Search PubMed for references concerning: CHEMBL4451596
    Title: Successful generation of structural information for fragment-based drug discovery
    Oster L, Tapani S, Xue Y, Kack H
    Ref: Drug Discov Today, 20:1104, 2015 : PubMed