COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810729
Chemical Name: (2Z)-3-[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(prop-2-en-1-yl)prop-2-enamide
Smiles: CCCCOc1ccc(cc1)c1nn(cc1/C=C(\C(=O)NCC=C)/C#N)c1ccccc1

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Molecular Weight: 426.52
Empirical Formula: C26H26N4O2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.462
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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