COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120637
Chemical Name: 3-{5-[(Z)-(5-cyano-1-ethyl-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: CCN1C(=O)/C(=C\c2ccc(o2)c2cccc(c2)C(=O)O)/C(=C(C1=O)C#N)C

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Molecular Weight: 376.37
Empirical Formula: C21H16N2O5

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 4.276
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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