COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993025
Chemical Name: (2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-ylmethanesulfonate
Smiles: Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OS(=O)(=O)C)c2c(c1)COCO2

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Molecular Weight: 408.82
Empirical Formula: C18H13ClO7S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 2.459
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 96
Number of rings: 4

     

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