COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL440315
Chemical Name: 4-nitro-2-[6,6,9,10-tetramethyl-2-(trifluoromethyl)-6,7-dihydropyrido[2,1-a]isoquinolinium-4-yl]phenolate
Smiles: [O-]c1ccc(cc1c1cc(cc2[n+]1C(C)(C)Cc1c2cc(C)c(c1)C)C(F)(F)F)[N+](=O)[O-]

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Molecular Weight: 442.44
Empirical Formula: C24H21F3N2O3

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 0.512
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 72
Number of rings: 4

     

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