COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295187
Chemical Name: (4E)-4-{[(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(c1)[N+](=O)[O-])[N+](=O)[O-])c1ccccc1C

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Molecular Weight: 381.35
Empirical Formula: C18H15N5O5

Physical State: Dry powder
Available Amount: 32 mg

Lipinsky:
logP: 3.385
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 136
Number of rings: 3

     

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