COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568047
Chemical Name: (5E)-1-ethyl-4,6-dioxo-5-{[(pyridinium-2-ylmethyl)amino]methylidene}-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: CCN1C(=NC(=O)/C(=C\NCc2cccc[nH+]2)/C1=O)[S-]

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Molecular Weight: 290.35
Empirical Formula: C13H14N4O2S

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 0.426
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 75
Number of rings: 2

     

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