NEFAZODONE HYDROCHLORIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (1994)
Entry Type: Small molecule
Molecule Category: Salt
UNII: 27X63J94GR
Parent Compound: NEFAZODONE

Structure
InChI Key DYCKFEBIOUQECE-UHFFFAOYSA-N
Smile CCc1nn(CCCN2CCN(c3cccc(Cl)c3)CC2)c(=O)n1CCOc1ccccc1.Cl
InChI
InChI=1S/C25H32ClN5O2.ClH/c1-2-24-27-31(25(32)30(24)18-19-33-23-10-4-3-5-11-23)13-7-12-28-14-16-29(17-15-28)22-9-6-8-21(26)20-22;/h3-6,8-11,20H,2,7,12-19H2,1H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H33Cl2N5O2
Molecular Weight 506.48
AlogP 3.55
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 10.0
Polar Surface Area 55.53
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 33.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Norepinephrine transporter inhibitor DailyMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Parent

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
General disorders and administration site conditions
15.62
Nervous system disorders
11.34
Psychiatric disorders
10.08
Gastrointestinal disorders
9.45
Musculoskeletal and connective tissue disorders
8.19
Cardiac disorders
6.93
Immune system disorders
6.17
Vascular disorders
5.67
Endocrine disorders
5.42
Injury, poisoning and procedural complications
5.04
Metabolism and nutrition disorders
4.79
Infections and infestations
3.15
Eye disorders
2.52
Investigations
2.52

Cross References

Resources Reference
ChEBI 7495
ChEMBL CHEMBL1200492
EPA CompTox DTXSID8046088
FDA SRS 27X63J94GR
Guide to Pharmacology 7247
KEGG C07256
PubChem 54911
SureChEMBL SCHEMBL41119
ZINC ZINC00538065
CONTENTS