COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK923836
Chemical Name: (2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl1,3-benzodioxole-5-carboxylate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 444.4
Empirical Formula: C25H16O8

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.289
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 97
Number of rings: 5

     

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