COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811490
Chemical Name: (2E)-3-[3-(4-butoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(2-methoxyethyl)prop-2-enamide
Smiles: CCCCOc1ccc(c(c1)C)c1nn(cc1/C=C(/C(=O)NCCOC)\C#N)c1ccccc1

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Molecular Weight: 458.56
Empirical Formula: C27H30N4O3

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 5.036
Rotatable bonds: 10
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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