COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL488167
Chemical Name: N,N-dimethyl-N-{[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}-2-(nonyloxy)-2-oxoethanaminium
Smiles: CCCCCCCCCOC(=O)C[N+](Cc1cn(nc1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)(C)C

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Saltdata: Cl-
Molecular Weight: 507.65
Empirical Formula: C29H39N4O4

Available Amount: 0 mg

Lipinsky:
logP: 4.287
Rotatable bonds: 13
H-donors: 0
H-acceptors: 4
PSA: 89
Number of rings: 3

     

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