COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512615
Chemical Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-oxo-4H-chromene-5,7-diyldiacetate
Smiles: CC(=O)Oc1cc(OC(=O)C)cc2c1c(=O)c(co2)c1ccc2c(c1)OCCCO2

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Molecular Weight: 410.38
Empirical Formula: C22H18O8

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 2.395
Rotatable bonds: 5
H-donors: 0
H-acceptors: 8
PSA: 97
Number of rings: 4

     

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