COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172684
Chemical Name: 4-[(4Z)-4-(3-bromo-5-methoxy-4-{2-[(2-methoxyphenyl)amino]-2-oxoethoxy}benzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: COc1cc(/C=C\2/C(=NN(C2=O)c2ccc(cc2)C(=O)O)C)cc(c1OCC(=O)Nc1ccccc1OC)Br

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Molecular Weight: 594.42
Empirical Formula: C28H24BrN3O7

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 4.062
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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