UCSF

ZINC40768934

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 15 Yes

Popular Name: (1R,5S)-N-ethyl-7-isopropyl-7-azabicyclo[3.3.1]nonan-9-amine (1R,5S)-N-ethyl-7-isopropyl-7-az…

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) 2.67 7.4 -43.43 3 2 0 21 212.381 3 ↓
Hi High (pH 8-9.5) 2.67 7.17 -33.62 2 2 1 20 211.373 3 ↓

Activity (Go SEA)

Rings

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