In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | Yes |
Popular Name: (1R,5S)-3-[(2R)-2-piperidyl]-8-azabicyclo[3.2.1]octan-3-ol (1R,5S)-3-[(2R)-2-piperidyl]-8-a…
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) | 0.98 | 1.12 | -95.64 | 5 | 3 | 2 | 53 | 212.337 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.98 | -0.13 | -43.32 | 4 | 3 | 1 | 49 | 211.329 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.