COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850989
Chemical Name: 9-butyl-8-(4-chlorophenyl)-2-hydroxy-1-methyl-1,9-dihydro-6H-purin-6-one
Smiles: CCCCn1c(nc2c1nc(O)n(c2=O)C)c1ccc(cc1)Cl

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Molecular Weight: 332.79
Empirical Formula: C16H17ClN4O2

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 1.986
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 3

     

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