UCSF

ZINC34590524

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 32 Yes

Popular Name: 6-(3-azabicyclo[3.2.2]nonan-3-yl)-N4-(4-fluorophenyl)-N2-(1,1,3,3-tetramethylbutyl)-1,3,5-triazine-2 6-(3-azabicyclo[3.2.2]nonan-3-yl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 7.67 20.15 -5.24 2 6 0 66 440.611 7 ↓
Lo Low (pH 4.5-6) 7.67 20.63 -27.39 3 6 1 67 441.619 7 ↓
Lo Low (pH 4.5-6) 7.67 18.39 -24.07 3 6 1 67 441.619 7 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4261892 IBM Patent Data

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