Structure

InChI Key CPBHSHYQQLFAPW-ZWKOTPCHSA-N
Smile COc1ccc(F)cc1C[C@@](O)(C1CCOCC1)[C@@H]1CNCCO1
InChI
InChI=1S/C18H26FNO4/c1-22-16-3-2-15(19)10-13(16)11-18(21,14-4-7-23-8-5-14)17-12-20-6-9-24-17/h2-3,10,14,17,20-21H,4-9,11-12H2,1H3/t17-,18+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H26FNO4
Molecular Weight 339.41
AlogP 1.52
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 59.95
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 24.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Norepinephrine transporter inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Depressive Disorder, Major 3 D003865 ClinicalTrials
Attention Deficit Disorder with Hyperactivity 2 D001289 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 1194508-25-2
ChEMBL CHEMBL2103857
DrugBank DB09184
EPA CompTox DTXSID70152464
FDA SRS 3W9N3F4JOO
PubChem 11186829
SureChEMBL SCHEMBL14072285
ZINC ZINC000038342901