Structure

InChI Key DJDFFEBSKJCGHC-UHFFFAOYSA-N
Smile Cl.c1ccc2c(CC3=NCCN3)cccc2c1
InChI
InChI=1S/C14H14N2.ClH/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14;/h1-7H,8-10H2,(H,15,16);1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H15ClN2
Molecular Weight 246.74
AlogP 2.38
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 24.39
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Adrenergic receptor alpha agonist PubMed PubMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Common Cold 4 D003139 ClinicalTrials
Influenza, Human 3 D007251 ClinicalTrials
Inflammation 3 D007249 ClinicalTrials
Pterygium 3 D011625 ClinicalTrials

Related Entries

Scaffolds

Parent
Mixture
Mixture

Adverse Reactions

System Organ Classification (SOC)
Relative Frequency (%)
Cardiac disorders
28.57
Vascular disorders
21.43
General disorders and administration site conditions
14.29
Injury, poisoning and procedural complications
14.29
Eye disorders
7.14
Investigations
7.14
Psychiatric disorders
7.14

Cross References

Resources Reference
ChEBI 7470
ChEMBL CHEMBL1706
EPA CompTox DTXSID7045788
FDA SRS MZ1131787D
Guide to Pharmacology 7310
KEGG C07898
PubChem 11079
SureChEMBL SCHEMBL24153
ZINC ZINC00125006