Synonyms
Status
Molecule Category Free-form
UNII B0SV3N7J3H

Structure

InChI Key OFYVIGTWSQPCLF-UHFFFAOYSA-N
Smiles Cc1ccc(C23CNCC2C3)cc1
InChI
InChI=1S/C12H15N/c1-9-2-4-10(5-3-9)12-6-11(12)7-13-8-12/h2-5,11,13H,6-8H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H15N
Molecular Weight 173.26
AlogP 1.86
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 12.03
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 13.0

Pharmacology

Mechanism of Action Action Reference
Monoamine transporter inhibitor INHIBITOR PubMed Other
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 55-910 - - -

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL511099
DrugBank DB04889
FDA SRS B0SV3N7J3H
PubChem 24768032
SureChEMBL SCHEMBL38793