COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK324962
Chemical Name: (4E)-2-(3-chlorophenyl)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=C/2\C(=NN(C2=O)c2cccc(c2)Cl)C)cc2c1oc(=O)s2

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Molecular Weight: 400.84
Empirical Formula: C19H13ClN2O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.644
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 93
Number of rings: 4

     

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