COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512983
Chemical Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(2,4,6-trihydroxyphenyl)ethanone
Smiles: Oc1cc(O)c(c(c1)O)C(=O)Cc1ccc2c(c1)OCCCO2

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Molecular Weight: 316.31
Empirical Formula: C17H16O6

Physical State: Dry powder
Available Amount: 32 mg

Lipinsky:
logP: 3.642
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 96
Number of rings: 3

     

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