COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582902
Chemical Name: 6-hydroxy-3-methyl-8-(4-methylpiperazin-1-yl)-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: CN1CCN(CC1)c1nc2c(n1CCSc1nnc(s1)C)c(O)nc(=O)n2C

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Molecular Weight: 422.54
Empirical Formula: C16H22N8O2S2

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 0.167
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 156
Number of rings: 4

     

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