COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473607
Chemical Name: ethyl2-{[(2E)-2-cyano-3-(2,4-diethoxyphenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: CCOc1ccc(c(c1)OCC)/C=C(/C(=O)Nc1sccc1C(=O)OCC)\C#N

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Molecular Weight: 414.48
Empirical Formula: C21H22N2O5S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 6.22
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 2

     

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