COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK977941
Chemical Name: (4E)-4-{[(4-methoxy-2-nitrophenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(c(c1)[N+](=O)[O-])N/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 352.35
Empirical Formula: C18H16N4O4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.718
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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