COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK613016
Chemical Name: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-(4-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)O)/C(=C(/c2ccc(cc2)F)\O)/C(=O)C1=O

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Molecular Weight: 474.51
Empirical Formula: C26H19FN2O4S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.893
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 118
Number of rings: 5

     

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