COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL350460
Chemical Name: ({(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile
Smiles: N#CCOc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

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Molecular Weight: 369.76
Empirical Formula: C19H12ClNO5

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 3.031
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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