Bioactive Compound Details

BioIDbio200580
NameDIVALPROEX SODIUM
ChEMBL IDCHEMBL2105613
Molecular FormulaC16H31NaO4
Molecular Weight310.41
Molecular Weight (Monoisotopic)144.115
TypeSmall molecule
Max PhasePhase 4
Target IDTar81
Target NameNone
SynonymsABBOTT 50711|ABBOTT-50711|DEPAKOTE|DEPAKOTE CP|DEPAKOTE ER|DIVALPROEX|DIVALPROEX SODIUM|SEMISODIUM VALPROATE|VALPROATE SEMISODIQUE|VALPROATE SEMISODIUM|VALPROATO SEMISODICO|VALPROIC ACID SODIUM SALT (2:1)
SmilesCCCC(CCC)C(=O)O.CCCC(CCC)C(=O)[O-].[Na+]
InchiInChI=1S/2C8H16O2.Na/c2*1-3-5-7(6-4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+1/p-1
Inchi KeyMSRILKIQRXUYCT-UHFFFAOYSA-M
Molecular SpeciesACID
Targets3.0
Bioactivities5.0
Np Likeness Score0.38
Records Key['Divalproex Sodium', 'DIVALPROEX SODIUM', 'DIVALPROEX SODIUM', 'Divalproex Sodium', 'DIVALPROEX SODIUM', 'Divalproex', 'DIVALPROEX SODIUM', 'Divalproex Sodium', 'DIVALPROEX SODIUM', 'DIVALPROEX SODIUM']
Records Name['Divalproex Sodium', 'DIVALPROEX SODIUM', 'DIVALPROEX SODIUM', 'Divalproex Sodium', 'DIVALPROEX SODIUM', 'Divalproex', 'DIVALPROEX SODIUM', 'Divalproex Sodium', 'DIVALPROEX SODIUM', None]
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure