COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK412829
Chemical Name: methyl4-cyano-3-methyl-5-[(3-methylbutanoyl)amino]thiophene-2-carboxylate
Smiles: COC(=O)c1sc(c(c1C)C#N)NC(=O)CC(C)C

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Molecular Weight: 280.35
Empirical Formula: C13H16N2O3S

Physical State: Dry powder
Available Amount: 879 mg

Lipinsky:
logP: 2.743
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 1

     

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