COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511994
Chemical Name: (4Z)-2-(3,4-dimethylphenyl)-5-hydroxy-4-[3-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: C#CCOc1ccc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C)C)O

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Molecular Weight: 376.41
Empirical Formula: C22H20N2O4

Physical State: Dry powder
Available Amount: 290 mg

Lipinsky:
logP: 3.969
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 3

     

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