COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363707
Chemical Name: methyl{[(1E)-3-amino-2-cyano-3-oxo-1-sulfanylprop-1-en-1-yl]sulfanyl}acetate
Smiles: COC(=O)CS/C(=C(/C(=O)N)\C#N)/S

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Molecular Weight: 232.28
Empirical Formula: C7H8N2O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.636
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 157
Number of rings: 0

     

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