COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675167
Chemical Name: 5-[(4Z)-4-(3-bromo-4-hydroxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]-2-chlorobenzoicacid
Smiles: COc1cc(/C=C\2/C(=NN(C2=O)c2ccc(c(c2)C(=O)O)Cl)C)cc(c1O)Br

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Molecular Weight: 465.69
Empirical Formula: C19H14BrClN2O5

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 3.532
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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