PENTAZOCINE HYDROCHLORIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (1969)
Entry Type: Small molecule
Molecule Category: Salt
UNII: A36BXO4PPX
Parent Compound: PENTAZOCINE

Structure
InChI Key OQGYMIIFOSJQSF-UHFFFAOYSA-N
Smile CC(C)=CCN1CCC2(C)c3cc(O)ccc3CC1C2C.Cl
InChI
InChI=1S/C19H27NO.ClH/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19;/h5-7,12,14,18,21H,8-11H2,1-4H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H28ClNO
Molecular Weight 321.89
AlogP 3.88
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 23.47
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 21.0

Pharmacology

Action Mechanism of Action Reference
MODULATOR Sigma opioid receptor modulator PubMed DailyMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Parent
Mixture
Mixture
Mixture

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
General disorders and administration site conditions
22.12
Psychiatric disorders
18.14
Infections and infestations
11.5
Skin and subcutaneous tissue disorders
11.5
Injury, poisoning and procedural complications
10.62
Vascular disorders
7.08
Musculoskeletal and connective tissue disorders
6.64
Gastrointestinal disorders
5.31
Social circumstances
3.98
Nervous system disorders
3.1

Cross References

Resources Reference
ChEMBL CHEMBL3989510
FDA SRS A36BXO4PPX
PubChem 441277
SureChEMBL SCHEMBL40964
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