COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL194193
Chemical Name: 8-chloro-1,3-dimethyl-9-[2-(4-methylphenyl)-2-oxoethyl]-3,9-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)C(=O)Cn1c(Cl)nc2c1n(C)c(=O)n(c2=O)C

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Molecular Weight: 346.77
Empirical Formula: C16H15ClN4O3

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 3.254
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 75
Number of rings: 3

     

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