Phyto4Health

Para-Methoxyamphetamine

Representations & DB's id

ChEBI: None
ChEMBL: CHEMBL278663
PubChem: 31721
IUPAC: 1-(4-methoxyphenyl)propan-2-amine
Standard InChI: InChI=1S/C10H15NO/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3
Standard InChI Key: NEGYEDYHPHMHGK-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)CC(N)C

Molecular propeties

AlogP: 1.58
Hydrogen bonds acceptors: 2
Hydrogen bonds donors: 1
Rotatable bonds: 3
Number of rings: 1
Molecular Weight: 165.12
Topological polar surface area: 35.2
Number of aromatic rings: 1
Fsp3: 0.4
Number of carbons: 10

Plant sources

Part of plant Plant name Ref.
PlantThymus vulgaris

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
EC501071519.31 nMSerotonin transporterP31645
EC5032359.37 nMSerotonin transporterP31645