UCSF

ZINC61322747

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2011 17 Yes

Popular Name: (1R,5S)-8-[(5-methylpyrazin-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-one (1R,5S)-8-[(5-methylpyrazin-2-yl…

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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) 0.44 2.82 -8.08 0 4 0 46 231.299 2 ↓
Mid Mid (pH 6-8) 0.44 4.93 -42.18 1 4 1 47 232.307 2 ↓

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

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