COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL030832
Chemical Name: {[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}aceticacid
Smiles: OC(=O)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O

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Molecular Weight: 340.29
Empirical Formula: C18H12O7

Physical State: Dry powder
Available Amount: 1092 mg

Lipinsky:
logP: 2.772
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 91
Number of rings: 4

     

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