Structure

InChI Key OGQDIIKRQRZXJH-UHFFFAOYSA-N
Smile CNCCCC1c2ccccc2C=Cc2ccccc21.Cl
InChI
InChI=1S/C19H21N.ClH/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19;/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H22ClN
Molecular Weight 299.85
AlogP 4.3
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 12.03
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Norepinephrine transporter inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Parent

Adverse Reactions

System Organ Classification (SOC)
Relative Frequency (%)
General disorders and administration site conditions
20.9
Injury, poisoning and procedural complications
19.4
Psychiatric disorders
17.16
Nervous system disorders
12.69
Cardiac disorders
7.46
Product issues
5.97
Immune system disorders
5.22
Gastrointestinal disorders
2.99
Investigations
2.99
Vascular disorders
2.99

Cross References

Resources Reference
ChEBI 8598
ChEMBL CHEMBL1200332
EPA CompTox DTXSID8046951
FDA SRS 44665V00O8
Guide to Pharmacology 7285
KEGG C07408
PubChem 14667
SureChEMBL SCHEMBL119341
ZINC ZINC01530764