UCSF

ZINC34583196

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 10 Yes

Popular Name: (4S,5R)-1-azabicyclo[3.3.1]nonan-4-amine (4S,5R)-1-azabicyclo[3.3.1]nonan…

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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) 0.11 0.47 -41.88 3 2 1 31 141.238 0 ↓
Mid Mid (pH 6-8) 0.11 2.41 -33.49 3 2 1 30 141.238 0 ↓
Mid Mid (pH 6-8) 0.11 2.68 -98.63 4 2 2 32 142.246 0 ↓

Activity (Go SEA)

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