COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK992266
Chemical Name: (2Z)-2-(4-tert-butylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl1,3-benzodioxole-5-carboxylate
Smiles: O=C1/C(=C/c2ccc(cc2)C(C)(C)C)/Oc2c1ccc(c2)OC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 442.47
Empirical Formula: C27H22O6

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.999
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 5

     

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