COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512687
Chemical Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(5-ethyl-2-hydroxy-4-methoxyphenyl)ethanone
Smiles: COc1cc(O)c(cc1CC)C(=O)Cc1ccc2c(c1)OCCCO2

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Molecular Weight: 342.39
Empirical Formula: C20H22O5

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 4.721
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 64
Number of rings: 3

     

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