COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406887
Chemical Name: (4E)-4-(2,5-dimethoxybenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)O)OC

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Molecular Weight: 324.34
Empirical Formula: C18H16N2O4

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 3.215
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 3

     

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