COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371430
Chemical Name: methyl[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-ethoxyphenoxy]acetate
Smiles: CCOc1cc(ccc1OCC(=O)OC)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N

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Molecular Weight: 426.47
Empirical Formula: C23H26N2O6

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 1.925
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 120
Number of rings: 3

     

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