COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045908
Chemical Name: 2-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)ammonio]methyl}phenolate
Smiles: [O-]c1ccccc1C[NH2+]c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 309.37
Empirical Formula: C18H19N3O2

Physical State: Dry powder
Available Amount: 277 mg

Lipinsky:
logP: 1.212
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 63
Number of rings: 3

     

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