COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK888835
Chemical Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-4-oxo-4H-chromen-7-ylmethanesulfonate
Smiles: CCc1cc2c(cc1OS(=O)(=O)C)occ(c2=O)c1ccc2c(c1)OCCCO2

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Molecular Weight: 416.45
Empirical Formula: C21H20O7S

Physical State: Dry powder
Available Amount: 383 mg

Lipinsky:
logP: 3.746
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 96
Number of rings: 4

     

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