COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047598
Chemical Name: methyl2-{(3E)-2-(3,4-dichlorophenyl)-3-[hydroxy(thiophen-2-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2cccs2)\O)/C(=O)C1=O

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Molecular Weight: 509.39
Empirical Formula: C21H14Cl2N2O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.296
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 153
Number of rings: 4

     

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