UCSF

ZINC69236210

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 19 Yes

Popular Name: (1R,5S)-9-[(1S)-1,4-dimethylpentyl]-N-ethyl-9-azabicyclo[3.3.1]nonan-7-amine (1R,5S)-9-[(1S)-1,4-dimethylpent…

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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) 4.03 9.31 -97.33 3 2 2 21 268.489 6 ↓
Hi High (pH 8-9.5) 4.03 8.27 -28.83 2 2 1 16 267.481 6 ↓
Mid Mid (pH 6-8) 4.03 7.45 -37.02 2 2 1 20 267.481 6 ↓

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

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