COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368015
Chemical Name: 2-chloro-5-{(4E)-3-methyl-5-oxo-4-[(2E)-3-phenylprop-2-en-1-ylidene]-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: CC1=NN(C(=O)/C/1=C/C=C/c1ccccc1)c1ccc(c(c1)C(=O)O)Cl

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Molecular Weight: 366.8
Empirical Formula: C20H15ClN2O3

Physical State: Dry powder
Available Amount: 388 mg

Lipinsky:
logP: 2.928
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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