COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK799027
Chemical Name: (2E)-2-cyano-N-ethyl-3-{3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Smiles: CCCCCCOc1ccc(cc1)c1nn(cc1/C=C(/C(=O)NCC)\C#N)c1ccccc1

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Molecular Weight: 442.56
Empirical Formula: C27H30N4O2

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 6.16
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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