Structure

InChI Key YNPFMWCWRVTGKJ-UHFFFAOYSA-N
Smiles CN1CCN2c3ccccc3Cc3ccccc3C2C1.Cl
InChI
InChI=1S/C18H20N2.ClH/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19;/h2-9,18H,10-13H2,1H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H21ClN2
Molecular Weight 300.83
AlogP 3.08
Hydrogen Bond Acceptor 2.0
Polar Surface Area 6.48
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cavia porcellus
- 190 - - -

Cross References

Resources Reference
ChEBI 31843
ChEMBL CHEMBL544428
FDA SRS 2X03TN217S
PubChem 68551
SureChEMBL SCHEMBL340474