nitrobenzylmercaptopurine ribonucleoside

Ligand id: 4512

Name: nitrobenzylmercaptopurine ribonucleoside

Abbreviated name: NBMPR

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 202.19
Molecular weight 435.08
XLogP 1.24
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S,3R,4S,5R)-2-(6-hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)-2-{[(2-nitrophenyl)methyl]sulfanyl}oxolane-3,4-diol
Synonyms
NBTI | nitrobenzylthioinosine
Database Links
PubChem CID 23624146
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Search UniChem for chemical match using the InChIKey NVQXRTPYOZKYMZ-GDLHICMESA-N
Search UniChem for chemicals with the same backbone NVQXRTPYOZKYMZ