COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848842
Chemical Name: (4E)-5-(3,4-dimethoxyphenyl)-1-(2-hydroxyethyl)-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccc(c(c1)OC)OC

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Molecular Weight: 428.4
Empirical Formula: C21H20N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.037
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 142
Number of rings: 3

     

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