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Inhibitor Report for: CHEMBL1375713

General
Type Sulfur Compound
Chemical_Nomenclature 2-(2-fluorophenyl)-N-[(5-methylthiophen-2-yl)methyl]ethanamine
Canonical SMILES CC1=CC=C(S1)CNCCC2=CC=CC=C2F
InChI InChI=1S/C14H16FNS/c1-11-6-7-13(17-11)10-16-9-8-12-4-2-3-5-14(12)15/h2-7,16H,8-10H2,1H3
InChIKey NZNHJQFNTSWMCR-UHFFFAOYSA-N
Other name(s) AN-465/42767298 ; N-[2-(2-fluorophenyl)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine ; BAS 10139544 ; AC1LYA64 ; 49Z
________________________________________________________________________________________________
MW|249.34
Formula|C14H16FNS
CAS_number|
PubChem|1817785
UniChem|NZNHJQFNTSWMCR-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | CHEMBL1375713 ligand of proteins in family: Epoxide_hydrolase
Stucture | 1 structure: 4Y2Y: Structure of soluble epoxide hydrolase in complex with 2-(2-fluorophenyl)-N-[(5-methyl-2-thienyl)methyl]ethanamine
Protein | human-EPHX2

References:
Search PubMed for references concerning: CHEMBL1375713
    Title: Identification of N-ethylmethylamine as a novel scaffold for inhibitors of soluble epoxide hydrolase by crystallographic fragment screening
    Amano Y, Tanabe E, Yamaguchi T
    Ref: Bioorganic & Medicinal Chemistry, :, 2015 : PubMed