Bioactive Compound Details

BioIDbio3182
NameCARBIDOPA
ChEMBL IDCHEMBL1200748
Molecular FormulaC10H16N2O5
Molecular Weight244.25
Molecular Weight (Monoisotopic)226.0954
TypeSmall molecule
Max PhasePhase 4
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsCARBIDOPA|CARBIDOPA COMPONENT OF CARBILEV|CARBIDOPA COMPONENT OF PARCOPA|CARBIDOPA COMPONENT OF SINEMET|CARBIDOPA HYDRATE|CARBIDOPA MONOHYDRATE|CARBIDOPUM MONOHYDRATE|Carbidopa hydrate|LODOSYN|Lodosyn|MK-486|NSC-751137|NSC-758190
SmilesC[C@@](Cc1ccc(O)c(O)c1)(NN)C(=O)O.O
InchiInChI=1S/C10H14N2O4.H2O/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6;/h2-4,12-14H,5,11H2,1H3,(H,15,16);1H2/t10-;/m0./s1
Inchi KeyQTAOMKOIBXZKND-PPHPATTJSA-N
Molecular SpeciesACID
Targets116.0
Bioactivities533.0
Np Likeness Score0.66
Records Key['63', 'CARBIDOPA', 'carbidopa', 'Carbidopa', '61', 'carbidopa', 'CARBIDOPA', 'Carbidopa', 'Carbidopa', '76', 'S-(-)-Carbidopa', 'NCGC00024596-03', 'S(-)-CARBIDOPA', '22', 'CARBIDOPA', 'S(-)-CARBIDOPA', 'CARBIDOPA', 'CARBIDOPA', 'CARBIDOPA']
Records Name['3-(3,4-Dihydroxy-phenyl)-2-hydrazino-2-methyl-propionic acid hydrate (carbidopa)', 'CARBIDOPA', 'carbidopa', '(2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid', 'S-Carbidopa', 'carbidopa', 'CARBIDOPA', 'Carbidopa', 'Carbidopa', 'S-(-)-Carbidopa', 'S-(-)-Carbidopa', 'S-(-)-Carbidopa', 'S(-)-CARBIDOPA', 'Carbidopa', 'CARBIDOPA', 'S(-)-Carbidopa', 'CARBIDOPA', 'CARBIDOPA', 'CARBIDOPA']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure