COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048309
Chemical Name: (5E)-1-(4-methylphenyl)-4,6-dioxo-5-{[(pyridinium-2-ylmethyl)amino]methylidene}-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: Cc1ccc(cc1)N1C(=NC(=O)/C(=C\NCc2cccc[nH+]2)/C1=O)[S-]

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Molecular Weight: 352.42
Empirical Formula: C18H16N4O2S

Available Amount: 0 mg

Lipinsky:
logP: 2.107
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 75
Number of rings: 3

     

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