6N3K-1
General
Type : Urea derivative
Chemical_Nomenclature : 1-[4-[(2,6-difluorophenyl)methoxy]cyclohexyl]-3-(3-phenylpropyl)urea
Canonical SMILES : C1CC(CCC1NC(=O)NCCCC2=CC=CC=C2)OCC3=C(C=CC=C3F)F
InChI : InChI=1S\/C23H28F2N2O2\/c24-21-9-4-10-22(25)20(21)16-29-19-13-11-18(12-14-19)27-23(28)26-15-5-8-17-6-2-1-3-7-17\/h1-4,6-7,9-10,18-19H,5,8,11-16H2,(H2,26,27,28)
InChIKey : YXIUOVJEXYHABJ-UHFFFAOYSA-N
Other name(s) : SCHEMBL3186559,SCHEMBL3186569,CHEMBL3353241
MW : 402.48
Formula : C23H28F2N2O2
CAS_number :
PubChem : 59168604
UniChem : YXIUOVJEXYHABJ-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : 6N3K-1 ligand of proteins in family: Epoxide_hydrolase
Stucture : 6N3K Crystal structure of an epoxide hydrolase from Trichoderma reesei in complex with 1
Protein : hypjq-g0r7e2
References (1)
| Title : The molecular structure of an epoxide hydrolase from Trichoderma reesei in complex with urea or amide-based inhibitors - de Oliveira_2019_Int.J.Biol.Macromol_129_653 |
| Author(s) : de Oliveira GS , Adriani PP , Ribeiro JA , Morisseau C , Hammock BD , Dias MVB , Chambergo FS |
| Ref : Int J Biol Macromol , 129 :653 , 2019 |
| Abstract : de Oliveira_2019_Int.J.Biol.Macromol_129_653 |
| ESTHER : de Oliveira_2019_Int.J.Biol.Macromol_129_653 |
| PubMedSearch : de Oliveira_2019_Int.J.Biol.Macromol_129_653 |
| PubMedID: 30771398 |
| Gene_locus related to this paper: hypjq-g0r7e2 |