COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594700
Chemical Name: ethyl4-(5-{(E)-[5-cyano-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/C(=O)N(C2CCS(=O)(=O)C2)C(=O)C(=C1C)C#N

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Molecular Weight: 494.52
Empirical Formula: C25H22N2O7S

Physical State: Dry powder
Available Amount: 396 mg

Lipinsky:
logP: 2.777
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 143
Number of rings: 4

     

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