bucladesine

Ligand id: 5485

Name: bucladesine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 13
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 173.8
Molecular weight 469.14
XLogP -0.22
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(4aR,6R,7R,7aR)-6-(6-butanamido-9H-purin-9-yl)-2-hydroxy-2-oxo-hexahydro-1,3,5,2$l^{5}-furo[3,2-d][1,3,2$l^{5}]dioxaphosphinin-7-yl butanoate
International Nonproprietary Names
INN number INN
5288 bucladesine
Synonyms
actosin | cyclic AMP dibutyrate | dbcAMP | dibutyryl cAMP
Database Links
CAS Registry No. 362-74-3
ChEBI CHEBI:50095
ChEMBL Ligand CHEMBL485980
GtoPdb PubChem SID 178102132
PubChem CID 9687
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Wikipedia Bucladesine