COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038509
Chemical Name: methyl4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-fluoro-1,3-benzothiazol-2-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)F

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Molecular Weight: 522.94
Empirical Formula: C26H16ClFN2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.183
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 5

     

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