COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563524
Chemical Name: (4E)-5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 492.59
Empirical Formula: C26H21FN2O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.184
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 5

     

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