UCSF

ZINC61367256

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 16 No

Popular Name: (1R,5S)-8-[(1S)-1-(3-thienyl)ethyl]-8-azabicyclo[3.2.1]octan-3-one (1R,5S)-8-[(1S)-1-(3-thienyl)eth…

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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) 1.84 7.7 -39.25 1 2 1 22 236.36 2 ↓
Mid Mid (pH 6-8) 1.84 5.74 -4.73 0 2 0 20 235.352 2 ↓

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

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