COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048911
Chemical Name: 2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])CSc1ncnc2c1cnn2Cc1ccccc1

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Molecular Weight: 405.44
Empirical Formula: C20H15N5O3S

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 3.254
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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