COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK607142
Chemical Name: ethyl3-({[1-(9H-purin-6-yl)piperidin-3-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)C1CCCN(C1)c1ncnc2c1nc[nH]2

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Molecular Weight: 394.43
Empirical Formula: C20H22N6O3

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 3.155
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 113
Number of rings: 4

     

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