COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK972747
Chemical Name: 3-({9-ethyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-9H-purin-6-yl}amino)benzonitrile
Smiles: COc1ccccc1N1CCN(CC1)c1nc(Nc2cccc(c2)C#N)c2c(n1)n(CC)cn2

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Molecular Weight: 454.53
Empirical Formula: C25H26N8O

Available Amount: 0 mg

Lipinsky:
logP: 2.205
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 95
Number of rings: 5

     

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