Bioactive Compound Details

BioIDbio198281
NameNone
ChEMBL IDCHEMBL1782214
Molecular FormulaC20H38O3S
Molecular Weight358.59
Molecular Weight (Monoisotopic)358.2542
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(Dodecylsulfinyl)Cyclohexyl Acetate
SmilesCCCCCCCCCCCC[S+]([O-])C1CCCCC1OC(C)=O
InchiInChI=1S/C20H38O3S/c1-3-4-5-6-7-8-9-10-11-14-17-24(22)20-16-13-12-15-19(20)23-18(2)21/h19-20H,3-17H2,1-2H3
Inchi KeyUIXJKRQTHMCKBN-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities2.0
Np Likeness Score0.66
Records Key['7']
Records Name['2-(dodecylsulfinyl)cyclohexyl acetate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure