SCHEMBL5255404
not a real inhibitor of sEH IC50 332 microM
General
Type : Pyridine
Chemical_Nomenclature : 2-[(5-bromopyridin-2-yl)-methylamino]ethanol
Canonical SMILES : CN(CCO)C1=NC=C(C=C1)Br
InChI : InChI=1S\/C8H11BrN2O\/c1-11(4-5-12)8-3-2-7(9)6-10-8\/h2-3,6,12H,4-5H2,1H3
InChIKey : FWDPWBASDJULOB-UHFFFAOYSA-N
Other name(s) : 2-((5-Bromopyridin-2-yl)(methyl)amino)ethanol || 2-[(5-Bromo-2-Pyridyl)-Methyl-Amino]ethanol || 2-[(5-bromopyridin-2-yl)(methyl)amino]ethanol || 4VY || Compound 6
MW : 231.09
Formula : C8H11BrN2O
CAS_number :
PubChem : 10657129
UniChem : FWDPWBASDJULOB-UHFFFAOYSA-N
Target
Families : SCHEMBL5255404 ligand of proteins in family
Epoxide_hydrolase
Protein :
human-EPHX2
References (2)
| Title : Exploring serial crystallography for drug discovery - Dunge_2024_IUCrJ__ |
| Author(s) : Dunge A , Phan C , Uwangue O , Bjelcic M , Gunnarsson J , Wehlander G , Kack H , Branden G |
| Ref : IUCrJ , : , 2024 |
| Abstract : |
| PubMedSearch : Dunge_2024_IUCrJ__ |
| PubMedID: 39072424 |
| Title : Successful generation of structural information for fragment-based drug discovery - Oster_2015_Drug.Discov.Today_20_1104 |
| Author(s) : Oster L , Tapani S , Xue Y , Kack H |
| Ref : Drug Discov Today , 20 :1104 , 2015 |
| Abstract : |
| PubMedSearch : Oster_2015_Drug.Discov.Today_20_1104 |
| PubMedID: 25931264 |
| Gene_locus related to this paper: human-EPHX2 |