COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432009
Chemical Name: methyl4-[(4E)-4-(3-methoxy-4-propoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Smiles: CCCOc1ccc(cc1OC)/C=C/1\C(=NN(C1=O)c1ccc(cc1)C(=O)OC)C

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Molecular Weight: 408.45
Empirical Formula: C23H24N2O5

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 4.181
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 3

     

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