Bioactive Compound Details

BioIDbio200451
NameVALPROIC ACID
ChEMBL IDCHEMBL109
Molecular FormulaC8H16O2
Molecular Weight144.21
Molecular Weight (Monoisotopic)144.115
TypeSmall molecule
Max PhasePhase 4
Target IDTar81
Target NameNone
Synonyms44089|ACIDE VALPROIQUE|ACIDO VALPROICO|CONVULEX|DEPAKENE|DEPAKOTE|NSC-93819|PENTANOIC ACID, 2-PROPYL|STAVZOR|VALPROATE|VALPROIC ACID|VALPROIC ACID EXTENDED RELEASE
SmilesCCCC(CCC)C(=O)O
InchiInChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
Inchi KeyNIJJYAXOARWZEE-UHFFFAOYSA-N
Molecular SpeciesACID
Targets321.0
Bioactivities4796.0
Np Likeness Score0.38
Records Key['Valproate', 'Valproic acid', 'valproic acid', 'Na valproate', 'Valproate', 'Valproic acid', 'Valproic acid', 'Valproate', 'valproate', 'Valproate', 'VALPROIC ACID', 'Valproic acid', 'valproate', 'Valproate', 'Valproate', 'Valproic Acid', 'Valproate', 'VALPROIC ACID', 'Valproate', 'valproate', 'Valproic acid', 'Valproic acid', 'Valproic acid', '1 (VPA)', 'valproic acid', 'VALPROIC ACID', 'Valproic acid', 'valproate', 'valproic acid', 'Valproic acid', '1', 'valproate', 'valproic acid', 'valproate', 'VALPROIC ACID', 'VPA', '374', '1, VPA', 'valproic acid', 'Valproate', 'SID17389523', 'valproate', 'Valproic acid', 'valproic acid', '4', 'Valproate', 'VPA', 'valproic acid', '1', 'Valproic acid', 'valproate', 'Valproic Acid', '190 (Valproate)', 'valproate', 'Valproic acid', 'Valproate', 'Valproic acid', '11, VPA', 'valproate', 'Valproic acid', 'Valproate', 'Valproic acid', 'valproate', 'valporic acid', 'Valproic Acd', 'valproic acid', '1, VPA', 'valproic acid', '236, valproic acid', 'valproic acid', 'Valproic acid', '1, VPA', 'valproic acid', 'SID26752921', 'Valproic acid', 'Valproic acid', 'valproic acid 4 millimolar', 'valproic acid 60 micromolar', 'Valproic Acid', 'Valproic acid', 'valproic acid', 'VPA', '1', 'Valproate', 'Valproate', 'Valproate', 'Valproic acid', 'Valproic acid', 'Valproic Acid', 'VPA', 'Valproate', 'Valproic acid', '1, VPA', 'Valproic Acid', 'VALPROIC ACID', 'Valproic acid', 'Valproic acid', 'SID144204642', 'SID144210920', 'Valproic acid', 'VPA', 'valproic acid', 'Valproic acid', 'Valproic acid', 'VPA', 'Valproic acid', '92', 'VALPROIC ACID', 'valproic acid', 'VAL', 'Valproic acid', 'Valproic acid', 'valproic acid', 'Valproic acid', 'SID174007029', 'SID170465446', 'VPA', 'Valproic acid', 'Valproic acid', 'VPA', 'Valproic Acid', 'VPA', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', '230', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'VPA', 'Valproic acid', 'Valproate', '1, VPA', 'SID399407', 'Valproate', 'VPA', 'valproic acid 15 micromolar', 'valproic acid 250 micromolar', 'valproic acid', 'Valproate', 'Valproate', 'Valproate', 'Valproate', 'Valproic acid', 'COVC-0141152659', 'valproic acid', 'VPA', 'Valproic acid', 'VPA', 'Valproic acid', 'ACIDE_VALPROIQUE', 'Valproic acid', 'SID90341449', 'SID144209161', '2; VPA', 'Valproic acid', 'VALPROIC ACID', 'Valproic acid', '5', 'Valproic Acid', 'Valproic Acid', 'Valproic acid', 'Valproate', 'Valproic acid', 'valproic acid', 'VPA', 'Valproic acid', 'Valproic acid', 'Valproate', 'Valproic acid', 'VALPROIC ACID', 'Valproate', 'VPA'
Records Name['2-Propyl-pentanoic acid (valproate)', '2-(2-Chloro-ethyl)-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'Valproic acid', 'Valproic acid', 'Valproate', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'VALPROIC ACID', '(Valproic acid)2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid (valproate)', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'Valproate', 'VALPROIC ACID', '3-Propyl-hexan-2-one', '2-Propyl-pentanoic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', None, '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid (valproate)', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid (valproate)', 'valproic acid', '2-Propyl-pentanoic acid', 'Valproic acid', 'Valproic acid', 'Valproic Acid', 'valproic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'SID17389523', '2-Propyl-pentanoic acid (valproate)', 'Valproic acid', '2-Propyl-pentanoic acid', 'Valproate', 'Valproate', '2-propylpentanoic acid', 'valproic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'valproate', '2-Propyl-pentanoic acid', 'Valproate2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'Valproic acid', 'valproate', 'Valproic acid', '2-Propyl-pentanoic acid', 'Valproic acid', '2-Propyl-pentanoic acid', 'valporic acid', 'Valproic Acid', '2-propylpentanoic acid', '2-propylpentanoic acid', '2-propylpentanoic acid', '2-propylpentanoic acid', 'valproic acid', 'Valproic acid', 'valproic acid', '2-propylpentanoic acid', 'SID26752921', 'Valproic acid', '2-propylpentanoic acid', 'valproic acid', 'valproic acid', 'Valproic acid', 'Valproic acid', 'valproic acid', 'valproate', '2-Propyl-pentanoic acid', 'Valproate', '2-Propyl-pentanoic acid', '2-Propyl-pentanoic acid', 'Valproic acid', 'Valproic acid', 'Valproic Acid', 'Valproic acid', 'Valproate', 'Valproic acid', 'valproic acid', 'Valproic Acid', 'VALPROIC ACID', 'Valproic acid', 'Valproic acid', 'SID144204642', 'SID144210920', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproate', 'VALPROIC ACID', 'valproic acid', 'valproic acid', 'Valproic acid', 'Valproic acid', 'valproic acid', 'Valproic acid', 'SID174007029', 'SID170465446', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic acid', 'Valproic Acid', 'Valpr
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure