Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key ICIDZHMCYAIUIJ-UHFFFAOYSA-N
Smiles N(=NC1=CC=CC=2C=CC=CC12)C3=CC=CC=4C=CC=CC34
InChI
InChI=1/C20H14N2/c1-3-11-17-15(7-1)9-5-13-19(17)21-22-20-14-6-10-16-8-2-4-12-18(16)20/h1-14H

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H14N2
Molecular Weight 282.12
AlogP 6.41
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 24.72
Heavy Atoms 22.0

Cross References

Resources Reference
CAS NUMBER 487-10-5
NORMAN SUSDAT
PubChem 10247