COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611107
Chemical Name: 8-[4-(3,4-dichlorobenzyl)piperazin-1-yl]-7-ethyl-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccc(c(c1)Cl)Cl

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Molecular Weight: 437.33
Empirical Formula: C19H22Cl2N6O2

Physical State: Dry powder
Available Amount: 270 mg

Lipinsky:
logP: 1.822
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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