UCSF

ZINC70308050

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2011 18 Yes

Popular Name: (1R,5S)-8-[(1S)-1-cyclopentylethyl]-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(1S)-1-cyclopentyleth…

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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) 3.38 8.64 -99.39 3 2 2 21 252.446 4 ↓
Hi High (pH 8-9.5) 3.38 7.46 -28.31 2 2 1 16 251.438 4 ↓
Mid Mid (pH 6-8) 3.38 6.65 -35.86 2 2 1 20 251.438 4 ↓

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

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