COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK751244
Chemical Name: 1-(2-hydroxyethyl)-5-{[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: OCCN1C(=O)/C(=C/c2c(C)nn(c2O)c2ccc(cc2)C)/C(=C(C1=O)C#N)C

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Molecular Weight: 392.41
Empirical Formula: C21H20N4O4

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 3.013
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 3

     

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