COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432822
Chemical Name: 5-[(4Z)-4-(3-bromobenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]-2-chlorobenzoicacid
Smiles: Brc1cccc(c1)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C(=O)O)Cl)C

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Molecular Weight: 419.66
Empirical Formula: C18H12BrClN2O3

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 3.967
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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