COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186407
Chemical Name: methyl(4-{(1Z)-3-[(4-chlorophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-ethoxyphenoxy)acetate
Smiles: CCOc1cc(ccc1OCC(=O)OC)/C=C(\C(=O)Nc1ccc(cc1)Cl)/C#N

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Molecular Weight: 414.85
Empirical Formula: C21H19ClN2O5

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 4.008
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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