COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563350
Chemical Name: 7-(2-chlorobenzyl)-8-[4-(3-chlorophenyl)piperazin-1-yl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1cccc(c1)N1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C

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Molecular Weight: 485.37
Empirical Formula: C23H22Cl2N6O2

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 3.325
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 5

     

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