COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039035
Chemical Name: (4E)-5-(4-tert-butylphenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: Fc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C(C)(C)C)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)F)/O

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Molecular Weight: 504.56
Empirical Formula: C28H22F2N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.378
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 5

     

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