COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083514
Chemical Name: (2E)-3-{5-bromo-2-[(2-cyanobenzyl)oxy]phenyl}-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(Br)ccc1OCc1ccccc1C#N)/C(=O)NCC1CCCO1

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Molecular Weight: 466.33
Empirical Formula: C23H20BrN3O3

Physical State: Dry powder
Available Amount: 334 mg

Lipinsky:
logP: 3.298
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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