UCSF

ZINC61322758

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2011 21 Yes

Popular Name: (1R,5S)-9-[(5-methylpyrazin-2-yl)methyl]-N-propyl-9-azabicyclo[3.3.1]nonan-7-amine (1R,5S)-9-[(5-methylpyrazin-2-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) 2.43 4.85 -46.31 2 4 1 46 289.447 5 ↓
Lo Low (pH 4.5-6) 2.43 6.65 -108.97 3 4 2 47 290.455 5 ↓

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Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.