COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK609240
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[2-(dimethylamino)ethyl]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CN(CCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 453.45
Empirical Formula: C23H23N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.789
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 125
Number of rings: 4

     

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