COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670476
Chemical Name: (4E)-4-{[(2-hydroxy-3,5-dinitrophenyl)amino]methylidene}-5-methyl-2-(2-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/Nc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-])c1ccccc1C

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Molecular Weight: 397.35
Empirical Formula: C18H15N5O6

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 3.878
Rotatable bonds: 1
H-donors: 2
H-acceptors: 6
PSA: 156
Number of rings: 3

     

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