COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK645324
Chemical Name: 7-[(2Z)-3-chlorobut-2-en-1-yl]-6-hydroxy-8-[(2-hydroxypropyl)sulfanyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CC(CSc1nc2c(n1C/C=C(\Cl)/C)c(O)nc(=O)n2C)O

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Molecular Weight: 344.82
Empirical Formula: C13H17ClN4O3S

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 2.036
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 2

     

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