COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055486
Chemical Name: 8-(4-ethylpiperazin-1-yl)-6-hydroxy-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-2H-purin-2-one
Smiles: CCN1CCN(CC1)c1nc2c(n1CCCSc1ncccn1)c(O)nc(=O)n2C

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Molecular Weight: 430.53
Empirical Formula: C19H26N8O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.537
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 128
Number of rings: 4

     

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