COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183654
Chemical Name: 3-[(4-{(1E)-2-cyano-3-[(3-ethoxyphenyl)amino]-3-oxoprop-1-en-1-yl}phenoxy)methyl]benzoicacid
Smiles: CCOc1cccc(c1)NC(=O)/C(=C/c1ccc(cc1)OCc1cccc(c1)C(=O)O)/C#N

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Molecular Weight: 442.47
Empirical Formula: C26H22N2O5

Physical State: Dry powder
Available Amount: 455 mg

Lipinsky:
logP: 5.452
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 3

     

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