In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (1S,8aR)-N-[(1R)-1-(1-propyl-4-piperidyl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(1R)-1-(1-propyl-4-p…
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) | 3.15 | 9.64 | -75.01 | 3 | 3 | 2 | 21 | 295.515 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 7.39 | -32.1 | 2 | 3 | 1 | 20 | 294.507 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 10.41 | -183.27 | 4 | 3 | 3 | 25 | 296.523 | 5 | ↓ |