Compound - Results

Valproic Acid

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Information Structure
Name Valproic acid
Synonyms
2-Propylpentanoic Acid
2-Propylvaleric Acid
3-02-00-00807 (Beilstein Handbook Reference)
4-Heptanecarboxylic Acid
44089
Abbott 44090
Acetic Acid, Dipropyl-
Acide Valproique
Acido Valproico
Acidum Valproicum
AI3-10500
BRN 1750447
Depakine
Di-n-propylacetic Acid
Di-n-propylessigsaure
Dipropylacetate
Dipropylacetic Acid
DPA (VAN)
DRG-0130
EINECS 202-777-3
Ergenyl
HSDB 3582
Kyselina 2-propylvalerova
Mylproin
n-Dipropylacetic Acid
NSC 93819
Propylvaleric Acid
Valproate
Valproic Acid
ATC N03AG01
CID 3121
CAS 000099661
Drugbank ID DB00313
TTD Drug ID DNC001659
SMILES CCCC(CCC)C(O)=O
Formula C8H16O2
Molweight 144.211
Atoms 10
LogP 2.2874
Rotatable Bonds 5
H-Bond Donors 0
H-Bond Acceptors 2
CYP interactions
NameRelationsReferences
1A2Inhibitor 10365650
2A6Substrate 15795555
15795555
2C8Inhibitor 9606477
2C9Substrate Inhibitor 9606477
15795555
2C18Inhibitor 9606477
2C19Substrate Inhibitor 9606477
15795555
11996015
3A4Inhibitor 10365650
4A11Inducer 1632818
Phase2 interactions
NameReferences
GST 19429109,
15009649,
18155166
UGT 17925173,
10757417,
17516704,
9929511,
16565174,
15470160,
17873515,
18838507
Transporter
AC-No.NameReferences
P08183P-glycoprotein 117392393
P78381Solute carrier family 35 member A212732356
Extrarenal fraction 0.95
Elimination half-life 12h