COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK529479
Chemical Name: ethyl(1Z)-1-(1-ethoxy-1,3-dioxobutan-2-ylidene)-3,5,7-trioxo-3,5,6,7-tetrahydro-1H-indeno[5,6-c]furan-6-carboxylate
Smiles: CCOC(=O)/C(=C/1\OC(=O)c2c1cc1c(c2)C(=O)C(C1=O)C(=O)OCC)/C(=O)C

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Saltdata: N(C2H5)3
Molecular Weight: 400.34
Empirical Formula: C20H16O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.188
Rotatable bonds: 7
H-donors: 0
H-acceptors: 9
PSA: 130
Number of rings: 3

     

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