Bioactive Compound Details

BioIDbio199714
NameCREATININE
ChEMBL IDCHEMBL65567
Molecular FormulaC4H7N3O
Molecular Weight113.12
Molecular Weight (Monoisotopic)113.0589
TypeSmall molecule
Max PhasePhase 3
Target IDTar81
Target NameNone
Synonyms1-METHYLGLYCOCYAMIDINE|1-METHYLHYDANTOIN-2-IMIDE|CREATININE|KREATININUM|NSC-13123
SmilesCN1CC(=O)NC1=N
InchiInChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)
Inchi KeyDDRJAANPRJIHGJ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets25.0
Bioactivities58.0
Np Likeness Score-0.32
Records Key['Creatinine', 'Creatinine', 'creatinine', '5', 'SID50085985', 'creatinine', 'SID26749779', 'creatinine', '6', 'CREATININE', 'SID144205069', 'Creatinine', 'SID170466777', '22', 'Creatinine', 'CREATININE', 'Creatinine', 'Creatinine', 'Creatinine', 'Creatinine', 'CREATININE', 'CREATININE', 'Creatinine', 'Creatinine', 'COVC-1751768172']
Records Name['2-Imino-1-methyl-imidazolidin-4-one', '2-Imino-1-methyl-imidazolidin-4-one', '2-Imino-1-methyl-imidazolidin-4-one', '2-Imino-1-methyl-imidazolidin-4-one', 'SID50085985', 'creatinine', 'SID26749779', 'creatinine', 'Creatinine', 'CREATININE', 'SID144205069', '2-Imino-1-methyl-imidazolidin-4-one', 'SID170466777', 'Creatinine', 'Creatinine', 'CREATININE', 'Creatinine', 'Creatinine', 'Creatinine', 'Creatinine', 'CREATININE', 'CREATININE', 'Creatinine', 'Creatinine', 'CREATININE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure