Bioactive Compound Details

BioIDbio197269
NameNone
ChEMBL IDCHEMBL191467
Molecular FormulaC6H11O7P
Molecular Weight226.12
Molecular Weight (Monoisotopic)226.0242
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms(R)-2-(Phosphonomethyl)Pentanedioic Acid
SmilesO=C(O)CC[C@@H](CP(=O)(O)O)C(=O)O
InchiInChI=1S/C6H11O7P/c7-5(8)2-1-4(6(9)10)3-14(11,12)13/h4H,1-3H2,(H,7,8)(H,9,10)(H2,11,12,13)/t4-/m0/s1
Inchi KeyISEYJGQFXSTPMQ-BYPYZUCNSA-N
Molecular SpeciesACID
Targets5.0
Bioactivities7.0
Np Likeness Score0.86
Records Key['(2R)-7', '1 (R)', 'PMPA', 'PMPA', 'PMPA']
Records Name['(R)-2-(phosphonomethyl)pentanedioic acid', '(R)-2-Phosphonomethyl-pentanedioic acid', 'PMPA', 'PMPA', 'PMPA']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure