COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL194192
Chemical Name: 8-chloro-9-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)C(=O)Cn1c(Cl)nc2c1n(C)c(=O)n(c2=O)C

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Molecular Weight: 362.77
Empirical Formula: C16H15ClN4O4

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 2.869
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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