COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381444
Chemical Name: 3-{[(2E)-2-cyano-3-(3-methoxy-2-{[(4-methylphenyl)sulfonyl]oxy}phenyl)prop-2-enoyl]amino}benzoicacid
Smiles: N#C/C(=C\c1cccc(c1OS(=O)(=O)c1ccc(cc1)C)OC)/C(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 492.51
Empirical Formula: C25H20N2O7S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 4.337
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 151
Number of rings: 3

     

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