COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562053
Chemical Name: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[furan-2-yl(hydroxy)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 475.48
Empirical Formula: C24H17N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.9
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 157
Number of rings: 5

     

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