COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511979
Chemical Name: (4Z)-4-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]-2-(3-chlorophenyl)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(/C=C\2/C(=NN(C2=O)c2cccc(c2)Cl)O)cc(c1OCc1ccccc1)Cl

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Molecular Weight: 483.35
Empirical Formula: C25H20Cl2N2O4

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 6.58
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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