In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 20 | Yes |
Popular Name: (1R,5S)-N-propyl-9-[(1S)-1-(3-thienyl)ethyl]-9-azabicyclo[3.3.1]nonan-7-amine (1R,5S)-N-propyl-9-[(1S)-1-(3-th…
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) | 3.82 | 7.72 | -38.92 | 2 | 2 | 1 | 20 | 293.5 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 9.42 | -102.41 | 3 | 2 | 2 | 21 | 294.508 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.