COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK662694
Chemical Name: 2-{(E)-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenyl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 477.5
Empirical Formula: C24H19N3O6S

Available Amount: 0 mg

Lipinsky:
logP: 4.345
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 130
Number of rings: 4

     

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