COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511977
Chemical Name: ethyl4-[(4Z)-4-(5-chloro-2-hydroxy-3-methoxybenzylidene)-3-hydroxy-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1N=C(/C(=C/c2cc(Cl)cc(c2O)OC)/C1=O)O

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Molecular Weight: 416.82
Empirical Formula: C20H17ClN2O6

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 4.661
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 108
Number of rings: 3

     

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