PENTOBARBITAL SODIUM

Search structure
Trade Names:
Synonyms:
Status: Approved (1973) Withdrawn (1980)
Entry Type: Small molecule
Molecule Category: Salt
UNII: NJJ0475N0S
Parent Compound: PENTOBARBITAL

Structure
InChI Key QGMRQYFBGABWDR-UHFFFAOYSA-M
Smile CCCC(C)C1(CC)C(=O)[N-]C(=O)NC1=O.[Na+]
InChI
InChI=1S/C11H18N2O3.Na/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15;/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H17N2NaO3
Molecular Weight 248.26
AlogP 1.18
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 75.27
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
POSITIVE ALLOSTERIC MODULATOR GABA-A receptor; anion channel positive allosteric modulator PubMed PubMed PubMed

Related Entries

Parent

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Metabolism and nutrition disorders
26.92
Infections and infestations
25.0
Nervous system disorders
19.23
Renal and urinary disorders
9.62
Respiratory, thoracic and mediastinal disorders
7.69
Vascular disorders
5.77

Cross References

Resources Reference
ChEBI 7984
ChEMBL CHEMBL971
EPA CompTox DTXSID9021712
FDA SRS NJJ0475N0S
KEGG C07423
PubChem 14075609
SureChEMBL SCHEMBL1247
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