2-Cl-ADP(α-BH3)

Ligand id: 8447

Name: 2-Cl-ADP(α-BH3)

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 5
Rotatable bonds 6
Topological polar surface area 231.99
Molecular weight 455
XLogP -3.71
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[[(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-phosphonooxyphosphoryl]boron(1-)
Database Links
GtoPdb PubChem SID 252166657
PubChem CID 71733822
Search Google for chemical match using the InChIKey XLTJNJOUVKOQCW-MWZJDIDNSA-N
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Search UniChem for chemicals with the same backbone XLTJNJOUVKOQCW