Ligand Id: 1766
Ligand name BX 048

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 12
Hydrogen bond donors 3
Rotatable bonds 14
Topological polar surface area 175.67
Molecular weight 558.23
XLogP 1.68
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
5-(4-ethoxycarbonylpiperazin-1-yl)-4-[[4-(1-hydroxy-2-methyl-1-oxopropan-2-yl)oxy-7-methylquinoline-2-carbonyl]amino]-5-oxopentanoic acid
Synonyms
an active metabolite of BX 667
Database Links
PubChem CID 16741348
Search on ChemSpider MCBLPJPMVOVJCO-UHFFFAOYSA-N
ZINC ZINC43199846, ZINC65731341

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