Bioactive Compound Details

BioIDbio199504
NameNone
ChEMBL IDCHEMBL1256573
Molecular FormulaC9H12ClNO4S
Molecular Weight265.72
Molecular Weight (Monoisotopic)265.0176
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Hydroxysaclofen
SmilesNCC(O)(CS(=O)(=O)O)c1ccc(Cl)cc1
InchiInChI=1S/C9H12ClNO4S/c10-8-3-1-7(2-4-8)9(12,5-11)6-16(13,14)15/h1-4,12H,5-6,11H2,(H,13,14,15)
Inchi KeyWBSMZVIMANOCNX-UHFFFAOYSA-N
Molecular SpeciesZWITTERION
Targets10.0
Bioactivities16.0
Np Likeness Score-0.43
Records Key['SID50104362', '2-Hydroxysaclofen', 'SID85230916', 'SID90341474', '2-hydroxysaclofen', '2-hydroxysaclofen', '2-HYDROXYSACLOFEN', '2-hydroxysaclofen']
Records Name['SID50104362', '2-Hydroxysaclofen', 'SID85230916', 'SID90341474', '2-hydroxysaclofen', '2-hydroxysaclofen', '2-HYDROXYSACLOFEN', '2-hydroxysaclofen']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure