Phyto4Health

3-[2-(Methylamino)Ethyl]-1H-Indol-5-Ol

Representations & DB's id

ChEBI: CHEBI:48294
ChEMBL: CHEMBL277362
PubChem: 150885
IUPAC: 3-[2-(methylamino)ethyl]-1H-indol-5-ol
Standard InChI: InChI=1S/C11H14N2O/c1-12-5-4-8-7-13-11-3-2-9(14)6-10(8)11/h2-3,6-7,12-14H,4-5H2,1H3
Standard InChI Key: ASUSBMNYRHGZIG-UHFFFAOYSA-N
SMILES: CNCCc1c[nH]c2c1cc(O)cc2

Molecular propeties

AlogP: 1.64
Hydrogen bonds acceptors: 2
Hydrogen bonds donors: 3
Rotatable bonds: 3
Number of rings: 2
Molecular Weight: 190.11
Topological polar surface area: 48
Number of aromatic rings: 2
Fsp3: 0.273
Number of carbons: 11

Plant sources

Part of plant Plant name Ref.
PlantRhaponticum carthamoides

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency35481.3 nMLysine-specific demethylase 4D-likeB2RXH2
Potency39810.7 nMCytochrome P450 2D6P10635
Potency1835.5 nMDopamine D1 receptorP21728
Potency10000 nMHistone-lysine N-methyltransferase, H3 lysine-9 specific 3Q96KQ7
Potency50118.7 nMChromobox protein homolog 1P83916