COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056944
Chemical Name: (5E)-5-({[4-(diethylammonio)phenyl]amino}methylidene)-1-(3,4-dimethylphenyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC[NH+](c1ccc(cc1)N/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)[O-])CC

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Molecular Weight: 406.48
Empirical Formula: C23H26N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.685
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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