COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK249112
Chemical Name: 4-[(1E)-2-cyano-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]-2-ethoxyphenyl3,4-dichlorobenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccc(c(c1)Cl)Cl)/C=C(/C(=O)c1ccc(cc1)C)\C#N

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Molecular Weight: 480.35
Empirical Formula: C26H19Cl2NO4

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 7.451
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 3

     

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