COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK584167
Chemical Name: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-[3-ethoxy-4-(3-methylbutoxy)benzylidene]-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCOc1cc(ccc1OCCC(C)C)/C=C/1\C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

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Molecular Weight: 486.59
Empirical Formula: C25H30N2O6S

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 3.268
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 122
Number of rings: 3

     

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