COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK857782
Chemical Name: 1-(3-methylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Smiles: Cc1cccc(c1)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 415.45
Empirical Formula: C22H21N7O2

Physical State: Dry powder
Available Amount: 362 mg

Lipinsky:
logP: 4.272
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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