COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675342
Chemical Name: 2-chloro-5-{(4Z)-3-methyl-4-[4-(methylsulfanyl)benzylidene]-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: CSc1ccc(cc1)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C(=O)O)Cl)C

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Molecular Weight: 386.86
Empirical Formula: C19H15ClN2O3S

Physical State: Dry powder
Available Amount: 540 mg

Lipinsky:
logP: 3.62
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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