COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL058694
Chemical Name: N-benzyl-N,N-dimethyl-2-[(3-nitrophenyl)amino]-2-oxoethanaminium
Smiles: O=C(C[N+](Cc1ccccc1)(C)C)Nc1cccc(c1)[N+](=O)[O-]

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Saltdata: Br-
Molecular Weight: 314.36
Empirical Formula: C17H20N3O3

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: -0.311
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 2

     

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