COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416754
Chemical Name: ethyl6-amino-4-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate
Smiles: C=CCOc1c(Br)cc(cc1OC)C1C(=C(N)OC(=C1C(=O)OCC)C)C#N

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Molecular Weight: 449.3
Empirical Formula: C20H21BrN2O5

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 3.324
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 103
Number of rings: 2

     

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