COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702473
Chemical Name: (2Z)-3-[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(3-methoxypropyl)prop-2-enamide
Smiles: CCCCOc1ccc(cc1C)c1nn(cc1/C=C(\C(=O)NCCCOC)/C#N)c1ccccc1

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Molecular Weight: 472.59
Empirical Formula: C28H32N4O3

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 5.253
Rotatable bonds: 11
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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