COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326912
Chemical Name: 3-methyl-1-{2-[(4-nitrophenyl)amino]-2-oxoethyl}pyridinium
Smiles: O=C(C[n+]1cccc(c1)C)Nc1ccc(cc1)[N+](=O)[O-]

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Saltdata: Br-
Molecular Weight: 272.28
Empirical Formula: C14H14N3O3

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: -1.548
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 2

     

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