CHEMBL3633668
IC50 0.0049 microM
General
Type : Urea derivative,Adamantyl
Chemical_Nomenclature : 1-(1-adamantylmethyl)-3-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]urea
Canonical SMILES : C1C2CC3CC1CC(C2)(C3)CNC(=O)NCC4=NOC(=C4)C5=CC=CO5
InChI : InChI=1S\/C20H25N3O3\/c24-19(21-11-16-7-18(26-23-16)17-2-1-3-25-17)22-12-20-8-13-4-14(9-20)6-15(5-13)10-20\/h1-3,7,13-15H,4-6,8-12H2,(H2,21,22,24)
InChIKey : RFNSZVQQDQMILH-UHFFFAOYSA-N
Other name(s) : 1-adamantyl-3-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]urea,3c,BDBM50133694,1-(adamant-1-ylmethyl)-3-{[5-(furan-2-yl)isoxazol-3-yl]methyl}urea
MW : 355.4
Formula : C20H25N3O3
CAS_number :
PubChem : 122195457
UniChem : RFNSZVQQDQMILH-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : CHEMBL3633668 ligand of proteins in family: Epoxide_hydrolase
Stucture :
Protein : human-EPHX2
References (2)
| Title : 1,3-Disubstituted and 1,3,3-trisubstituted adamantyl-ureas with isoxazole as soluble epoxide hydrolase inhibitors - Burmistrov_2015_Bioorg.Med.Chem.Lett_25_5514 |
| Author(s) : Burmistrov V , Morisseau C , Danilov D , Harris TR , Dalinger I , Vatsadze I , Shkineva T , Butov GM , Hammock BD |
| Ref : Bioorganic & Medicinal Chemistry Lett , 25 :5514 , 2015 |
| Abstract : Burmistrov_2015_Bioorg.Med.Chem.Lett_25_5514 |
| ESTHER : Burmistrov_2015_Bioorg.Med.Chem.Lett_25_5514 |
| PubMedSearch : Burmistrov_2015_Bioorg.Med.Chem.Lett_25_5514 |
| PubMedID: 26520661 |
| Title : Synthesis and Study of 1,3- and 1,3,3-Substituted Ureas Containing Isoxazole and Adamantane Fragments - Butov_2015_Chem.Heterocycl.Comp_50_171 |
| Author(s) : Butov GM , Burmistrov VV , Dalinger IL , Vatsadze IA , Shkineva TK , Danilov DV |
| Ref : Chem Heterocycl Comp , 50 :1719 , 2015 |
| Abstract : Butov_2015_Chem.Heterocycl.Comp_50_171 |
| ESTHER : Butov_2015_Chem.Heterocycl.Comp_50_171 |
| PubMedSearch : Butov_2015_Chem.Heterocycl.Comp_50_171 |
| PubMedID: |