compound 18b [PMID: 16242323]

Ligand id: 6728

Name: compound 18b [PMID: 16242323]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 13
Topological polar surface area 86.8
Molecular weight 619.33
XLogP 8.7
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,2-dihydro-1,8-naphthyridin-3-yl]-1-{4-[(dimethylamino)methyl]-2,6-bis(propan-2-yl)phenyl}urea hydrochloride
Database Links
PubChem CID 73755236
Search Google for chemical match using the InChIKey YCGQPIRMLGEWMW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YCGQPIRMLGEWMW
Search UniChem for chemical match using the InChIKey YCGQPIRMLGEWMW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YCGQPIRMLGEWMW