COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811242
Chemical Name: (2E)-3-[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(piperidin-1-ylcarbonyl)prop-2-enenitrile
Smiles: CCCOc1ccc(c(c1)C)c1nn(cc1/C=C(/C(=O)N1CCCCC1)\C#N)c1ccccc1

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Molecular Weight: 454.57
Empirical Formula: C28H30N4O2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.785
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 71
Number of rings: 4

     

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