COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL181627
Chemical Name: ethyl[4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-bromo-6-methoxyphenoxy]acetate
Smiles: CCOC(=O)COc1c(Br)cc(cc1OC)C1C(=C(N)OC2=C1C(=O)CCC2)C#N

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Molecular Weight: 477.31
Empirical Formula: C21H21BrN2O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.584
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 120
Number of rings: 3

     

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