Bioactive Compound Details

BioIDbio199779
NameN-CHLOROETHYL-N-ETHYL-2'-METHYLBENZYLAMINE HYDROCHLORIDE
ChEMBL IDCHEMBL1355604
Molecular FormulaC12H19Cl2N
Molecular Weight248.2
Molecular Weight (Monoisotopic)211.1128
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCCN(CCCl)Cc1ccccc1C.Cl
InchiInChI=1S/C12H18ClN.ClH/c1-3-14(9-8-13)10-12-7-5-4-6-11(12)2;/h4-7H,3,8-10H2,1-2H3;1H
Inchi KeyGAAOKTBHSXYRNH-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets7.0
Bioactivities15.0
Np Likeness Score-1.46
Records Key['SID26748564', N-CHLOROETHYL-N-ETHYL-2'-METHYLBENZYLAMINE HYDROCHLORIDE", '5']"
Records Name['SID26748564', N-CHLOROETHYL-N-ETHYL-2'-METHYLBENZYLAMINE HYDROCHLORIDE", 'N-(2-chloroethyl)-N-ethyl-2-methylbenzylamine hydrochloride']"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure