Statements (23)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:chemical_compound
|
| gptkbp:ATCCode |
none
|
| gptkbp:CASNumber |
15352-57-7
|
| gptkbp:drugClass |
norepinephrine reuptake inhibitor
|
| gptkbp:hasActivity |
antidepressant
|
| gptkbp:hasBiologicalActivity |
inhibits norepinephrine reuptake
|
| gptkbp:hasInChIKey |
QKJXYYOQSYFJNP-UHFFFAOYSA-N
|
| gptkbp:hasMolecularFormula |
C17H19NO3
|
| gptkbp:hasSMILES |
COC1=CC=CC=C1OCC(CN(C)C)C2=CC=CC=C2
|
| gptkbp:hasStandardInChI |
InChI=1S/C17H19NO3/c1-18(2)12-15(13-6-4-3-5-7-13)11-21-17-10-8-9-14(16-17)19-20/h3-10,15H,11-12H2,1-2H3
|
| gptkbp:hasUNII |
6T6UO8361S
|
| https://www.w3.org/2000/01/rdf-schema#label |
CHEMBL44961
|
| gptkbp:IUPACName |
gptkb:(RS)-3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine
|
| gptkbp:molecularWeight |
285.34
|
| gptkbp:PubChem_CID |
gptkb:CHEMBL44961
4488 |
| gptkbp:routeOfAdministration |
oral
|
| gptkbp:status |
experimental
|
| gptkbp:structureType |
small molecule
|
| gptkbp:synonym |
gptkb:Nisoxetine
|
| gptkbp:target |
gptkb:norepinephrine_transporter
|
| gptkbp:bfsParent |
gptkb:oxycodone
|
| gptkbp:bfsLayer |
7
|