UCSF

ZINC49394253

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 15 No

Popular Name: 1-[(5-bromo-2-thienyl)methyl]-4-aza-1-azoniabicyclo[2.2.2]octane 1-[(5-bromo-2-thienyl)methyl]-4-…

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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) -1.45 6.44 -33.86 0 2 1 3 288.234 2 ↓
Mid Mid (pH 6-8) -1.45 8.95 -109.85 1 2 2 4 289.242 2 ↓

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

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