COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371424
Chemical Name: ethyl6-amino-5-cyano-4-{4-[(2-cyanobenzyl)oxy]-3-ethoxy-5-iodophenyl}-2-methyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1cc(I)c(c(c1)OCC)OCc1ccccc1C#N)C#N)N

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Molecular Weight: 585.4
Empirical Formula: C26H24IN3O5

Physical State: Dry powder
Available Amount: 1036 mg

Lipinsky:
logP: 4.375
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 127
Number of rings: 3

     

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