COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL566045
Chemical Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-ylN-[(benzyloxy)carbonyl]-beta-alaninate
Smiles: O=C(Oc1ccc2c(c1)occ(c2=O)c1ccc2c(c1)OCCO2)CCNC(=O)OCc1ccccc1

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Molecular Weight: 501.49
Empirical Formula: C28H23NO8

Physical State: Liquid
Available Amount: 55 mg

Lipinsky:
logP: 4.487
Rotatable bonds: 8
H-donors: 1
H-acceptors: 8
PSA: 109
Number of rings: 5

     

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