COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK475192
Chemical Name: ethyl2-({(2E)-2-cyano-3-[2-(pentyloxy)phenyl]prop-2-enoyl}amino)thiophene-3-carboxylate
Smiles: CCCCCOc1ccccc1/C=C(/C(=O)Nc1sccc1C(=O)OCC)\C#N

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Molecular Weight: 412.51
Empirical Formula: C22H24N2O4S

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: 7.457
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 2

     

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