CHEMBL3114611

General

Type : Cyclopropyl, Piperidine, Urea derivative, Carboxamide

Chemical_Nomenclature : 4-phenoxy-N-[(1S,2R)-2-phenylcyclopropyl]piperidine-1-carboxamide

Canonical SMILES : C1CN(CCC1OC2=CC=CC=C2)C(=O)NC3CC3C4=CC=CC=C4

InChI : InChI=1S\/C21H24N2O2\/c24-21(22-20-15-19(20)16-7-3-1-4-8-16)23-13-11-18(12-14-23)25-17-9-5-2-6-10-17\/h1-10,18-20H,11-15H2,(H,22,24)\/t19-,20+\/m1\/s1

InChIKey : SAKQSHLUPVUJDT-UXHICEINSA-N

Other name(s) : BDBM50446781


MW : 336.42

Formula : C21H24N2O2

CAS_number :

PubChem : 76325076

UniChem : SAKQSHLUPVUJDT-UXHICEINSA-N

Target

Families : CHEMBL3114611 ligand of proteins in family
Epoxide_hydrolase

Structure :
4X6Y

Protein :
human-EPHX2

References (1)

Title : Three-dimensional rational approach to the discovery of potent substituted cyclopropyl urea soluble epoxide hydrolase inhibitors - Takai_2015_Bioorg.Med.Chem.Lett_25_1705
Author(s) : Takai K , Chiyo N , Nakajima T , Nariai T , Ishikawa C , Nakatani S , Ikeno A , Yamamoto S , Sone T
Ref : Bioorganic & Medicinal Chemistry Lett , 25 :1705 , 2015
Abstract :
PubMedSearch : Takai_2015_Bioorg.Med.Chem.Lett_25_1705
PubMedID: 25800114
Gene_locus related to this paper: human-EPHX2