COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561671
Chemical Name: methyl2-[(3E)-3-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 523.52
Empirical Formula: C25H21N3O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.551
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 180
Number of rings: 4

     

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