UCSF

ZINC62997447

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 20 Yes

Popular Name: (1R,5S)-8-[4-(diethylamino)phenyl]-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[4-(diethylamino)pheny…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

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) 2.54 7.54 -73.06 4 3 0 35 275.44 4 ↓
Mid Mid (pH 6-8) 2.54 7.45 -45.74 3 3 1 34 274.432 4 ↓

Activity (Go SEA)

Rings

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

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