COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK469971
Chemical Name: methyl2-({(2E)-2-cyano-3-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]prop-2-enoyl}amino)thiophene-3-carboxylate
Smiles: COc1ccc(cc1)c1n[nH]cc1/C=C(/C(=O)Nc1sccc1C(=O)OC)\C#N

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Molecular Weight: 408.44
Empirical Formula: C20H16N4O4S

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 4.617
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 3

     

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