Synonyms: | |
Status: | Approved (1987) |
Entry Type: | Small molecule |
Molecule Category: | Parent |
UNII: | I9W7N6B1KJ |
InChI Key | GIYXAJPCNFJEHY-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C17H19ClF3NO |
Molecular Weight | 345.79 |
AlogP | 4.44 |
Hydrogen Bond Acceptor | 2.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 21.26 |
Molecular species | BASE |
Aromatic Rings | 2.0 |
Heavy Atoms | 22.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Serotonin receptor
|
- | - | - | 72 | - | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC06 neurotransmitter transporter family
|
- | 150 | - | 1 | 44 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Depressive Disorder | 2 | D003866 | ClinicalTrials |
Panic Disorder | 2 | D016584 | ClinicalTrials |
Resources | Reference |
---|---|
ChEBI | 145458 |
ChEMBL | CHEMBL1201082 |
EPA CompTox | DTXSID7020635 |
FDA SRS | I9W7N6B1KJ |
SureChEMBL | SCHEMBL33384 |