COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052355
Chemical Name: (5E)-2-hydroxy-6-oxo-5-(1-{[2-(piperazin-1-ium-1-yl)ethyl]amino}ethylidene)-5,6-dihydropyrimidin-4-olate
Smiles: OC1=NC(=O)/C(=C(/NCC[NH+]2CCNCC2)\C)/C(=N1)[O-]

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Molecular Weight: 281.31
Empirical Formula: C12H19N5O3

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: -0.824
Rotatable bonds: 4
H-donors: 4
H-acceptors: 3
PSA: 113
Number of rings: 2

     

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