COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL484771
Chemical Name: 4-[(5Z)-5-[3-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2,4,6-trioxotetrahydropyrimidin-1(2H)-yl]benzoicacid
Smiles: C#CCOc1c(Br)cc(cc1OC)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(=O)O

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Molecular Weight: 499.27
Empirical Formula: C22H15BrN2O7

Physical State: Dry powder
Available Amount: 497 mg

Lipinsky:
logP: 2.946
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 122
Number of rings: 3

     

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