COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK629925
Chemical Name: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1nnc(s1)C)/O

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Molecular Weight: 452.45
Empirical Formula: C21H16N4O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.252
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 166
Number of rings: 4

     

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