UCSF

ZINC53432547

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 16 Yes

Popular Name: 2-[(1R,4S)-2-azabicyclo[2.2.1]heptan-2-yl]-N-[[(3S)-tetrahydrofuran-3-yl]methyl]ethanamine 2-[(1R,4S)-2-azabicyclo[2.2.1]he…

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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) 1.16 5.64 -116.54 3 3 2 30 226.364 5 ↓
Mid Mid (pH 6-8) 1.16 4.31 -33.21 2 3 1 26 225.356 5 ↓
Mid Mid (pH 6-8) 1.16 3.39 -41.11 2 3 1 29 225.356 5 ↓

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

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