COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378818
Chemical Name: 1-(2-bromophenyl)-3-{(E)-[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}-2,5-dimethyl-1H-pyrrole
Smiles: [O-][N+](=O)c1cc(ccc1N/N=C/c1cc(n(c1C)c1ccccc1Br)C)[N+](=O)[O-]

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Molecular Weight: 458.27
Empirical Formula: C19H16BrN5O4

Physical State: Dry powder
Available Amount: 392 mg

Lipinsky:
logP: 7.439
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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