COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK789675
Chemical Name: ethyl(3Z)-3-(4-butylbenzylidene)-1-hydroxy-4-oxo-3,4-dihydronaphthalene-2-carboxylate
Smiles: CCCCc1ccc(cc1)/C=C\1/C(=C(O)c2c(C1=O)cccc2)C(=O)OCC

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Molecular Weight: 376.45
Empirical Formula: C24H24O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.15
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 3

     

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