Bioactive Compound Details

BioIDbio199107
NameNone
ChEMBL IDCHEMBL1795478
Molecular FormulaC12H17ClN2O3
Molecular Weight272.73
Molecular Weight (Monoisotopic)236.1161
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms4-Acetamidophenyl 2-(Dimethylamino)Acetate Hydrochloride
SmilesCC(=O)Nc1ccc(OC(=O)CN(C)C)cc1.Cl
InchiInChI=1S/C12H16N2O3.ClH/c1-9(15)13-10-4-6-11(7-5-10)17-12(16)8-14(2)3;/h4-7H,8H2,1-3H3,(H,13,15);1H
Inchi KeyIWELEKYECKSPNI-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score-1.16
Records Key['4a']
Records Name['4-Acetamidophenyl 2-(dimethylamino)acetate hydrochloride']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure