Phyto4Health

1,2,3,9-Tetrahydropyrrolo[2,1-B]Quinazoline

Representations & DB's id

ChEBI: CHEBI:4428
ChEMBL: CHEMBL355821
PubChem: 442894
IUPAC: 1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline
Standard InChI: InChI=1S/C11H12N2/c1-2-5-10-9(4-1)8-13-7-3-6-11(13)12-10/h1-2,4-5H,3,6-8H2
Standard InChI Key: WUFQLZTXIWKION-UHFFFAOYSA-N
SMILES: C1CC2=Nc3c(CN2C1)cccc3

Molecular propeties

AlogP: 2.33
Hydrogen bonds acceptors: 2
Hydrogen bonds donors: 0
Rotatable bonds: 0
Number of rings: 3
Molecular Weight: 172.1
Topological polar surface area: 15.6
Number of aromatic rings: 1
Fsp3: 0.364
Number of carbons: 11

Plant sources

Part of plant Plant name Ref.
PlantPeganum harmala
PlantPeganum harmala
PlantPeganum harmala

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.