COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472671
Chemical Name: (2E)-2-cyano-3-{3-[(2-fluorobenzyl)oxy]phenyl}-N-(2,4,4-trimethylpentan-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cccc(c1)OCc1ccccc1F)/C(=O)NC(CC(C)(C)C)(C)C

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Molecular Weight: 408.52
Empirical Formula: C25H29FN2O2

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 5.772
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 62
Number of rings: 2

     

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