Bioactive Compound Details

BioIDbio200111
NameNone
ChEMBL IDCHEMBL2325411
Molecular FormulaC23H25NS
Molecular Weight347.53
Molecular Weight (Monoisotopic)347.1708
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-((3,4-Dimethylphenyl)Diphenylmethylthio)Ethanamine
SmilesCc1ccc(C(SCCN)(c2ccccc2)c2ccccc2)cc1C
InchiInChI=1S/C23H25NS/c1-18-13-14-22(17-19(18)2)23(25-16-15-24,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,17H,15-16,24H2,1-2H3
Inchi KeyYHBSZKUCSQEUNF-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets2.0
Bioactivities2.0
Np Likeness Score-0.6
Records Key['35']
Records Name['2-((3,4-dimethylphenyl)diphenylmethylthio)ethanamine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure