COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041451
Chemical Name: (4E)-5-(2-chlorophenyl)-1-[2-(2-hydroxyethoxy)ethyl]-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/O)/C1c1ccccc1Cl

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Molecular Weight: 446.84
Empirical Formula: C21H19ClN2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.817
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 132
Number of rings: 3

     

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