COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK063479
Chemical Name: (4E)-4-[2-(3-chlorophenyl)hydrazinylidene]-5-(4-nitrophenyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1cccc(c1)N/N=C/1\C(=NN(C1=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 419.83
Empirical Formula: C21H14ClN5O3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.341
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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