COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811234
Chemical Name: (2E)-2-cyano-N-(4-ethoxyphenyl)-3-{3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Smiles: C=CCOc1ccc(c(c1)C)c1nn(cc1/C=C(/C(=O)Nc1ccc(cc1)OCC)\C#N)c1ccccc1

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Molecular Weight: 504.59
Empirical Formula: C31H28N4O3

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 7.001
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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