UCSF

ZINC70189953

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 20 Yes

Popular Name: 2-[1-[[(3R)-1,4-dioxaspiro[4.4]nonan-3-yl]methyl]-4-piperidyl]-N-methyl-ethanamine 2-[1-[[(3R)-1,4-dioxaspiro[4.4]n…

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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) 2.63 7.5 -91.85 3 4 2 40 284.444 5 ↓
Hi High (pH 8-9.5) 2.63 5.2 -40.15 2 4 1 38 283.436 5 ↓

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Rings

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

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