COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052884
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-hydroxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Smiles: Oc1ccc(cc1)C1N(CCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

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Molecular Weight: 457.48
Empirical Formula: C27H23NO6

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.298
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 96
Number of rings: 5

     

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