Phyto4Health

Diphenylamine

Representations & DB's id

ChEBI: CHEBI:4640
ChEMBL: CHEMBL38688
PubChem: 11487
IUPAC: N-phenylaniline
Standard InChI: InChI=1S/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H
Standard InChI Key: DMBHHRLKUKUOEG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)Nc1ccccc1

Molecular propeties

AlogP: 3.43
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 2
Number of rings: 2
Molecular Weight: 169.09
Topological polar surface area: 12
Number of aromatic rings: 2
Fsp3: 0
Number of carbons: 12

Plant sources

Part of plant Plant name Ref.
PlantCapsicum annuum

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency31622.8 nMEndoplasmic reticulum-associated amyloid beta-peptide-binding proteinQ99714
Potency56234.1 nMHistone-lysine N-methyltransferase, H3 lysine-9 specific 3Q96KQ7
Others12 pm/min/mgUDP-glucuronosyltransferase 1-3P35503
Others240 pm/min/mgUDP-glucuronosyltransferase 1A4P22310
Others15 pm/min/mgUDP-glucuronosyltransferase 1-8Q9HAW9
Potency5011.9 nMGlycoprotein hormones alpha chainP01215