COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK629039
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CN(CCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)[N+](=O)[O-])C

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Molecular Weight: 467.48
Empirical Formula: C24H25N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.913
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 125
Number of rings: 4

     

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