COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL176526
Chemical Name: methyl6-amino-4-{5-bromo-2-[(3-fluorobenzyl)oxy]phenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1cc(Br)ccc1OCc1cccc(c1)F)C#N)N

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Molecular Weight: 473.3
Empirical Formula: C22H18BrFN2O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.212
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 94
Number of rings: 3

     

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