COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201408
Chemical Name: 3-({4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]phenoxy}methyl)benzoicacid
Smiles: N#C/C(=C/c1ccc(cc1)OCc1cccc(c1)C(=O)O)/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 400.39
Empirical Formula: C23H16N2O5

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 5.54
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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