COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262613
Chemical Name: 8-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(c(c1)N1CCN(CC1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C)C

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Molecular Weight: 388.86
Empirical Formula: C18H21ClN6O2

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 2.353
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 75
Number of rings: 4

     

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