COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383464
Chemical Name: 3-{[(2E)-2-cyano-3-{3-ethoxy-4-[(phenylcarbonyl)oxy]phenyl}prop-2-enoyl]amino}benzoicacid
Smiles: CCOc1cc(ccc1OC(=O)c1ccccc1)/C=C(/C(=O)Nc1cccc(c1)C(=O)O)\C#N

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Molecular Weight: 456.45
Empirical Formula: C26H20N2O6

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 5.302
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 125
Number of rings: 3

     

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