Ligand Id: 4280
Ligand name P552-02

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 6
Rotatable bonds 12
Topological polar surface area 194.99
Molecular weight 451.17
XLogP 0.73
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
IUPAC Name
3,5-diamino-6-chloro-N-(N'-{4-[4-(2,3-dihydroxypropoxy)phenyl]butyl}carbamimidoyl)pyrazine-2-carboxamide
Synonyms
N-(3,5-diamino-6-chloropyrazine-2-carbonyl)-N'-4-[4-(2,3-dihydroxypropoxy)phenyl]butyl-guanidine methanesulfonate
Database Links
Search on ChemSpider NTRKMGDUWYBLMS-UHFFFAOYSA-N
ZINC ZINC34271593, ZINC34663723

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org