COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041444
Chemical Name: (5Z)-5-{[(4-{[2-(diethylammonio)ethoxy]carbonyl}phenyl)amino]methylidene}-1-(4-fluorophenyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC[NH+](CCOC(=O)c1ccc(cc1)N/C=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)F)[O-])CC

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Molecular Weight: 468.48
Empirical Formula: C24H25FN4O5

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 2.976
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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