COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL004386
Chemical Name: 4-(acetylamino)-1-[2-(3-nitrophenyl)-2-oxoethyl]pyridinium
Smiles: CC(=O)Nc1cc[n+](cc1)CC(=O)c1cccc(c1)[N+](=O)[O-]

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Saltdata: Br-
Molecular Weight: 300.29
Empirical Formula: C15H14N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -3.423
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 2

     

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