COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598928
Chemical Name: 8-[4-(4-chlorobenzyl)piperazin-1-yl]-6-hydroxy-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: Clc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

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Molecular Weight: 428.92
Empirical Formula: C21H25ClN6O2

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 2.201
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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