COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528807
Chemical Name: 3-{(3E)-2-(3,4-dimethoxyphenyl)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: COc1cc(ccc1OC)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

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Molecular Weight: 485.49
Empirical Formula: C28H23NO7

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.031
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 113
Number of rings: 4

     

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