COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585832
Chemical Name: (4E)-1-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[furan-2-yl(hydroxy)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Smiles: CCSc1nnc(s1)N1C(c2cccc(c2)OC)/C(=C(/c2ccco2)\O)/C(=O)C1=O

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Molecular Weight: 443.5
Empirical Formula: C20H17N3O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.677
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 159
Number of rings: 4

     

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