Bioactive Compound Details

BioIDbio197437
NameNone
ChEMBL IDCHEMBL164863
Molecular FormulaC13H28NO5P
Molecular Weight309.34
Molecular Weight (Monoisotopic)309.1705
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(Cyclohexyloxy)Ethyl 2-(Trimethylammonio)Ethyl Phosphate
SmilesC[N+](C)(C)CCOP(=O)([O-])OCCOC1CCCCC1
InchiInChI=1S/C13H28NO5P/c1-14(2,3)9-10-18-20(15,16)19-12-11-17-13-7-5-4-6-8-13/h13H,4-12H2,1-3H3
Inchi KeyKTDKLFUFYJRSBY-UHFFFAOYSA-N
Molecular SpeciesACID
Targets2.0
Bioactivities4.0
Np Likeness Score0.54
Records Key['9', '1']
Records Name['1-{2-[(Cyclohexyloxyethyloxy)hydroxyphosphinyloxy]-ethyl}-N,N,N-trimethylammonium', '2-(cyclohexyloxy)ethyl 2-(trimethylammonio)ethyl phosphate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure