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Inhibitor Report for: CHEMBL4465514

IC50: 15 nM human-EPHX2


General
Type Piperidine, Carboxamide, Sulfur Compound
Chemical_Nomenclature N-(5,5-dioxodibenzothiophen-2-yl)-4,4-difluoropiperidine-1-carboxamide
Canonical SMILES C1CN(CCC1(F)F)C(=O)NC2=CC3=C(C=C2)S(=O)(=O)C4=CC=CC=C43
InChI InChI=1S/C18H16F2N2O3S/c19-18(20)7-9-22(10-8-18)17(23)21-12-5-6-16-14(11-12)13-3-1-2-4-15(13)26(16,24)25/h1-6,11H,7-10H2,(H,21,23)
InChIKey CHISZLOVTPVOGH-UHFFFAOYSA-N
Other name(s) BDBM50534963 ; Q27456466 ; 6N0
________________________________________________________________________________________________
MW|378.4
Formula|C18H16F2N2O3S
CAS_number|
PubChem|91754971
UniChem|CHISZLOVTPVOGH-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | CHEMBL4465514 ligand of proteins in family: Epoxide_hydrolase
Stucture | 1 structure: 5AKE: ligand complex structure of soluble epoxide hydrolase
Protein | human-EPHX2

References:
Search PubMed for references concerning: CHEMBL4465514
    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