COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362070
Chemical Name: 3-{[(2E)-2-cyano-3-{4-[(phenylsulfonyl)oxy]phenyl}prop-2-enoyl]amino}benzoicacid
Smiles: N#C/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccccc1)/C(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 448.46
Empirical Formula: C23H16N2O6S

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 4.253
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 141
Number of rings: 3

     

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