COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK885679
Chemical Name: ethyl5-cyano-2-methyl-5-(prop-2-en-1-yl)-4-(thiophen-2-yl)-6-thioxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Smiles: C=CCC1(C#N)C(=S)NC(=C(C1c1cccs1)C(=O)OCC)C

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Molecular Weight: 346.47
Empirical Formula: C17H18N2O2S2

Physical State: Dry powder
Available Amount: 43 mg

Lipinsky:
logP: 3.8
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 122
Number of rings: 2

     

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