COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK846163
Chemical Name: (4E)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1sc2c(n1)ccc(c2)C)/O

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Molecular Weight: 489.48
Empirical Formula: C25H16FN3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.828
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 144
Number of rings: 5

     

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