Bioactive Compound Details

BioIDbio197225
NameNone
ChEMBL IDCHEMBL2172378
Molecular FormulaC13H9NaO3
Molecular Weight236.2
Molecular Weight (Monoisotopic)214.063
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsSodium 2-Phenoxybenzoate
SmilesO=C([O-])c1ccccc1Oc1ccccc1.[Na+]
InchiInChI=1S/C13H10O3.Na/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10;/h1-9H,(H,14,15);/q;+1/p-1
Inchi KeyVCHBJBURBGLXHZ-UHFFFAOYSA-M
Molecular SpeciesACID
Targets1.0
Bioactivities1.0
Np Likeness Score-0.38
Records Key['Page no 7915, R34C2']
Records Name['sodium 2-phenoxybenzoate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure