COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393438
Chemical Name: 4-({4-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]phenoxy}methyl)benzoicacid
Smiles: CCOC(=O)/C(=C/c1ccc(cc1)OCc1ccc(cc1)C(=O)O)/C#N

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Molecular Weight: 351.36
Empirical Formula: C20H17NO5

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 3.637
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 2

     

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