COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368013
Chemical Name: 2-chloro-5-[(4E)-4-{[1-(3,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CC1=NN(C(=O)/C/1=C/c1cn(nc1c1ccccc1)Cc1ccc(c(c1)Cl)Cl)c1ccc(c(c1)C(=O)O)Cl

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Molecular Weight: 565.84
Empirical Formula: C28H19Cl3N4O3

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 5.668
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 5

     

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