COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902192
Chemical Name: dimethyl2-{[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]amino}benzene-1,4-dicarboxylate
Smiles: N#C/C(=C\Nc1cc(ccc1C(=O)OC)C(=O)OC)/S(=O)(=O)c1ccccc1

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Molecular Weight: 400.41
Empirical Formula: C19H16N2O6S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 3.61
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 130
Number of rings: 2

     

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