COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK635627
Chemical Name: 3-{8-[(4-ethoxyphenyl)amino]-6-hydroxy-3-methyl-2-oxo-2,3-dihydro-7H-purin-7-yl}propanenitrile
Smiles: CCOc1ccc(cc1)Nc1nc2c(n1CCC#N)c(O)nc(=O)n2C

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Molecular Weight: 354.37
Empirical Formula: C17H18N6O3

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 0.946
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 3

     

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