COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587949
Chemical Name: 8-(4-ethylpiperazin-1-yl)-1,3-dimethyl-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CCSc1ncccn1)c(=O)n(c(=O)n2C)C

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Molecular Weight: 430.53
Empirical Formula: C19H26N8O2S

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 1.381
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 4

     

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