COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK589049
Chemical Name: 7-(3-chlorobenzyl)-8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: Clc1cccc(c1)Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 499.4
Empirical Formula: C24H24Cl2N6O2

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 3.319
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 5

     

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