COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK613554
Chemical Name: (4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCN(C)C)/O

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Molecular Weight: 425.44
Empirical Formula: C22H23N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.009
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 115
Number of rings: 3

     

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