COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044262
Chemical Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2cc(OC)c(c(c2)OC)OC)/C(=C(/c2ccc(cc2)F)\O)/C(=O)C1=O

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Molecular Weight: 564.59
Empirical Formula: C29H25FN2O7S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 5.524
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 135
Number of rings: 5

     

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