COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK515353
Chemical Name: (5E)-5-{[3-(3-fluoro-4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: OCCCN1C(=O)/C(=C/c2cn(nc2c2ccc(c(c2)F)C)c2ccccc2)/C(=C(C1=O)C#N)C

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Molecular Weight: 470.5
Empirical Formula: C27H23FN4O3

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 4.389
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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