COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK792118
Chemical Name: methylN-(4-cyano-1-phenyl-1H-pyrazol-5-yl)-3,3,3-trifluoro-2-{[(3-methylphenyl)carbonyl]amino}alaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1c(C#N)cnn1c1ccccc1)NC(=O)c1cccc(c1)C

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Molecular Weight: 457.41
Empirical Formula: C22H18F3N5O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.929
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 109
Number of rings: 3

     

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