COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK596692
Chemical Name: 6-hydroxy-3-methyl-7-(3-methylbenzyl)-8-[(naphthalen-2-ylmethyl)sulfanyl]-3,7-dihydro-2H-purin-2-one
Smiles: Cc1cccc(c1)Cn1c(SCc2ccc3c(c2)cccc3)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 442.54
Empirical Formula: C25H22N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.524
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 5

     

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