COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK379912
Chemical Name: (2E,5E)-2-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]-5-(1-ethylquinolin-2(1H)-ylidene)-3-(4-methylphenyl)-1,3-thiazolidin-4-one
Smiles: CCn1/c(=c\2/s/c(=C/3\C(=NN(C3=O)c3ccc(cc3)Cl)C)/n(c2=O)c2ccc(cc2)C)/ccc2c1cccc2

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Molecular Weight: 553.08
Empirical Formula: C31H25ClN4O2S

Physical State: Dry powder
Available Amount: 587 mg

Lipinsky:
logP: 5.603
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 81
Number of rings: 6

     

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