COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847023
Chemical Name: (4E)-4-[furan-2-yl(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 412.38
Empirical Formula: C18H12N4O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.928
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 170
Number of rings: 4

     

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