COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419625
Chemical Name: (4-{(1Z)-3-[(3-chloro-2-methylphenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-ethoxyphenoxy)aceticacid
Smiles: CCOc1cc(ccc1OCC(=O)O)/C=C(\C(=O)Nc1cccc(c1C)Cl)/C#N

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Molecular Weight: 414.85
Empirical Formula: C21H19ClN2O5

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 4.32
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 2

     

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