Bioactive Compound Details

BioIDbio198101
Name2-PENTANOL
ChEMBL IDCHEMBL45065
Molecular FormulaC5H12O
Molecular Weight88.15
Molecular Weight (Monoisotopic)88.0888
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Pentanol|Pentan-2-ol
SmilesCCCC(C)O
InchiInChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3
Inchi KeyJYVLIDXNZAXMDK-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities4.0
Np Likeness Score1.07
Records Key['27', '17', '22', 'J1']
Records Name['Pentan-2-ol', '2-Pentanol', '2-Pentanol', '2-Pentanol']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure