COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038730
Chemical Name: 2-{[(E)-{1-[2-(4-fluorophenyl)ethyl]-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene}methyl]amino}-N,N,N-trimethylethanaminium
Smiles: Fc1ccc(cc1)CCN1C(=O)N=C(/C(=C\NCC[N+](C)(C)C)/C1=O)O

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Saltdata: I-
Molecular Weight: 363.41
Empirical Formula: C18H24FN4O3

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: -2.691
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 82
Number of rings: 2

     

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