COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049992
Chemical Name: (5E)-1-(4-methoxyphenyl)-2,6-dioxo-5-{1-[(pyridinium-3-ylmethyl)amino]propylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)OC)[O-])/NCc1ccc[nH+]c1

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Molecular Weight: 380.4
Empirical Formula: C20H20N4O4

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 1.609
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 108
Number of rings: 3

     

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