Structure

InChI Key SKYZYDSNJIOXRL-BTQNPOSSSA-N
Smile CN1CCc2cccc3c2[C@H]1Cc1ccc(O)c(O)c1-3.Cl
InChI
InChI=1S/C17H17NO2.ClH/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12;/h2-6,13,19-20H,7-9H2,1H3;1H/t13-;/m1./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H18ClNO2
Molecular Weight 303.79
AlogP 2.85
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 0.0
Polar Surface Area 43.7
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Action Mechanism of Action Reference
AGONIST D2-like dopamine receptor agonist ISBN DailyMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Neoplasms 1 D009369 ClinicalTrials
Osteoporosis 1 D010024 ClinicalTrials

Related Entries

Scaffolds

Parent

Adverse Reactions

System Organ Classification (SOC)
Relative Frequency (%)
Nervous system disorders
17.92
General disorders and administration site conditions
17.35
Psychiatric disorders
10.1
Gastrointestinal disorders
8.5
Injury, poisoning and procedural complications
8.26
Vascular disorders
7.99
Skin and subcutaneous tissue disorders
6.93
Cardiac disorders
5.91
Respiratory, thoracic and mediastinal disorders
5.24
Musculoskeletal and connective tissue disorders
3.82
Investigations
2.54

Cross References

Resources Reference
ChEBI 48538
ChEMBL CHEMBL1616
EPA CompTox DTXSID5040598
FDA SRS 9K13MD7A0D
Guide to Pharmacology 33
KEGG D07460
PubChem 107882
SureChEMBL SCHEMBL8524
ZINC ZINC00009073