COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958319
Chemical Name: 4-{(4Z)-4-[3-chloro-5-ethoxy-4-(2-ethoxy-2-oxoethoxy)benzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: CCOC(=O)COc1c(Cl)cc(cc1OCC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C(=O)O)C

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Molecular Weight: 486.91
Empirical Formula: C24H23ClN2O7

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.942
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 114
Number of rings: 3

     

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