COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046987
Chemical Name: (4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-fluoro-1,3-benzothiazol-2-yl)-5-(4-methylphenyl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)F)/O

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Molecular Weight: 488.54
Empirical Formula: C27H21FN2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.618
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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