COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK335860
Chemical Name: dimethyl(2E,2'E)-3,3'-[(3-amino-2-cyano-3-oxoprop-1-ene-1,1-diyl)disulfanediyl]bisprop-2-enoate
Smiles: COC(=O)/C=C/S/C(=C(\C(=O)N)/C#N)/S/C=C/C(=O)OC

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Molecular Weight: 328.37
Empirical Formula: C12H12N2O5S2

Available Amount: 0 mg

Lipinsky:
logP: -0.367
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 170
Number of rings: 0

     

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