COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK637351
Chemical Name: (4E)-4-[(2,4-dimethoxyphenyl)(hydroxy)methylidene]-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: COc1ccc(c(c1)OC)/C(=C\1/C(c2cccnc2)N(C(=O)C1=O)c1sc(c(n1)C)C)/O

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Molecular Weight: 451.5
Empirical Formula: C23H21N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.237
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 4

     

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