COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL412335
Chemical Name: (4E)-5-hydroxy-4-(4-hydroxy-3,5-dimethoxybenzylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=C/2\C(=NN(C2=O)c2ccccc2)O)cc(c1O)OC

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Molecular Weight: 340.34
Empirical Formula: C18H16N2O5

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 2.057
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 91
Number of rings: 3

     

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