COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565915
Chemical Name: (4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-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-])c1nc2c(s1)cc(cc2)OC)/O

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Molecular Weight: 517.52
Empirical Formula: C26H19N3O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.22
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 163
Number of rings: 5

     

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