COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810372
Chemical Name: (2E)-2-cyano-N-(3-methoxypropyl)-3-[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Smiles: CCCOc1ccc(c(c1)C)c1nn(cc1/C=C(/C(=O)NCCCOC)\C#N)c1ccccc1

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Molecular Weight: 458.56
Empirical Formula: C27H30N4O3

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.722
Rotatable bonds: 10
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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