In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | Yes |
Popular Name: (7R,8S)-7-[(3R)-3-ethyl-1-piperidyl]-1,4-dioxaspiro[4.5]decan-8-amine (7R,8S)-7-[(3R)-3-ethyl-1-piperi…
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) | 1.39 | 5.47 | -119.19 | 4 | 4 | 2 | 51 | 270.417 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 3.49 | -40.81 | 3 | 4 | 1 | 49 | 269.409 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 5.22 | -31.93 | 3 | 4 | 1 | 49 | 269.409 | 2 | ↓ |