COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185146
Chemical Name: methyl(4-{(1E)-3-[(5-chloro-2-methylphenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-ethoxyphenoxy)acetate
Smiles: CCOc1cc(ccc1OCC(=O)OC)/C=C(/C(=O)Nc1cc(Cl)ccc1C)\C#N

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Molecular Weight: 428.87
Empirical Formula: C22H21ClN2O5

Physical State: Dry powder
Available Amount: 371 mg

Lipinsky:
logP: 4.388
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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