COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040458
Chemical Name: (4E)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(c2cccc(c2)O)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O

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Molecular Weight: 428.4
Empirical Formula: C21H20N2O8

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 1.486
Rotatable bonds: 9
H-donors: 3
H-acceptors: 8
PSA: 153
Number of rings: 3

     

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