COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039329
Chemical Name: (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cccs2)N(C(=O)C1=O)c1sc(c(n1)C)C)/O

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Molecular Weight: 440.54
Empirical Formula: C22H20N2O4S2

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.053
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 136
Number of rings: 4

     

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