COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053794
Chemical Name: (5E)-1-cycloheptyl-5-({[2-(diethylammonio)ethyl]amino}methylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC[NH+](CCN/C=C/1\C(=NC(=O)N(C1=O)C1CCCCCC1)[O-])CC

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Molecular Weight: 350.46
Empirical Formula: C18H30N4O3

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 2.306
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 2

     

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