COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK412967
Chemical Name: methyl5-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate
Smiles: COC(=O)c1sc(c(c1C)C#N)NC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 344.35
Empirical Formula: C16H12N2O5S

Physical State: Dry powder
Available Amount: 299 mg

Lipinsky:
logP: 2.851
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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