COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045400
Chemical Name: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]-5-(2-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccccc1C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=O)/C/1=C(\c1cccs1)/O

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Molecular Weight: 476.58
Empirical Formula: C25H20N2O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.28
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 136
Number of rings: 5

     

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