COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK619414
Chemical Name: (4E)-5-(1,3-benzodioxol-5-yl)-4-[hydroxy(thiophen-2-yl)methylidene]-1-(6-methylpyridin-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1cccc(n1)N1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1ccc2c(c1)OCO2

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Molecular Weight: 420.45
Empirical Formula: C22H16N2O5S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.454
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 5

     

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