COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431359
Chemical Name: 3-[(4Z)-4-{4-[(4-chlorobenzyl)oxy]-3-ethoxybenzylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)/C=C\1/C(=NN(C1=O)c1cccc(c1)C(=O)O)C

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Molecular Weight: 490.94
Empirical Formula: C27H23ClN2O5

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 5.598
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 88
Number of rings: 4

     

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