COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507720
Chemical Name: methyl4-{(4Z)-4-[4-(2-ethoxy-2-oxoethoxy)-3-methoxybenzylidene]-3-hydroxy-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Smiles: CCOC(=O)COc1ccc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C(=O)OC)O

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Molecular Weight: 454.44
Empirical Formula: C23H22N2O8

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.795
Rotatable bonds: 9
H-donors: 1
H-acceptors: 8
PSA: 123
Number of rings: 3

     

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