COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052516
Chemical Name: ethyl(1E)-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-N,N-diethylethanamine(1:1)
Smiles: CCN(CC)CC.CCOC(=O)/C(=C\1/OC(=O)c2c1cc1c(c2)C(=O)C(C1=O)C(=O)OCC)/C(=O)C

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Molecular Weight: 501.53
Empirical Formula: C26H31NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 7
H-donors: 0
H-acceptors: 9
PSA: 133
Number of rings: 3

     

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