Bioactive Compound Details

BioIDbio198223
NameNone
ChEMBL IDCHEMBL31637
Molecular FormulaC8H18O
Molecular Weight130.23
Molecular Weight (Monoisotopic)130.1358
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Ethylhexanol
SmilesCCCCC(CC)CO
InchiInChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
Inchi KeyYIWUKEYIRIRTPP-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets8.0
Bioactivities8.0
Np Likeness Score1.5
Records Key['2-Ethylhexanol', '26', 'SID85272315', 'SID144209269', 'SID17389883', '2-Ethyl-1-hexanol']
Records Name['2-Ethylhexanol', '2-Ethyl-hexan-1-ol', 'SID85272315', 'SID144209269', 'SID17389883', '2-Ethyl-1-hexanol']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure