COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586351
Chemical Name: 8-[bis(2-hydroxyethyl)amino]-6-hydroxy-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: OCCN(c1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C)CCO

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Molecular Weight: 433.46
Empirical Formula: C20H27N5O6

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: -0.357
Rotatable bonds: 12
H-donors: 4
H-acceptors: 6
PSA: 143
Number of rings: 3

     

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