COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049045
Chemical Name: (5Z)-5-{1-[(4-methylpiperazin-4-ium-1-yl)amino]ethylidene}-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)\C)/C1=O)[O-]

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Molecular Weight: 307.35
Empirical Formula: C14H21N5O3

Physical State: Dry powder
Available Amount: 286 mg

Lipinsky:
logP: -0.677
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 92
Number of rings: 2

     

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