COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041277
Chemical Name: (5E)-5-{[(4-{[2-(diethylammonio)ethoxy]carbonyl}phenyl)amino]methylidene}-1-(4-methoxybenzyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C\Nc2ccc(cc2)C(=O)OCC[NH+](CC)CC)/C1=O)[O-]

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Molecular Weight: 494.55
Empirical Formula: C26H30N4O6

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 2.918
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 124
Number of rings: 3

     

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