COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK992687
Chemical Name: (2Z)-7-(azepan-1-ylmethyl)-2-[(6-bromo-4H-1,3-benzodioxin-8-yl)methylidene]-6-hydroxy-1-benzofuran-3(2H)-one
Smiles: Brc1cc(/C=C/2\Oc3c(C2=O)ccc(c3CN2CCCCCC2)O)c2c(c1)COCO2

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Molecular Weight: 486.36
Empirical Formula: C24H24BrNO5

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.366
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 68
Number of rings: 5

     

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