COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049628
Chemical Name: (5E)-5-{1-[(4-methylpiperazin-4-ium-1-yl)amino]propylidene}-2,6-dioxo-1-(prop-2-en-1-yl)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: C=CCN1C(=O)N=C(/C(=C(\NN2CC[NH+](CC2)C)/CC)/C1=O)[O-]

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Molecular Weight: 321.38
Empirical Formula: C15H23N5O3

Physical State: Dry powder
Available Amount: 277 mg

Lipinsky:
logP: -0.146
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 92
Number of rings: 2

     

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