In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (7S,8R)-7-(4-ethoxy-1-piperidyl)-N-methyl-1,4-dioxaspiro[4.5]decan-8-amine (7S,8R)-7-(4-ethoxy-1-piperidyl)…
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) | 0.67 | 5.96 | -112.82 | 3 | 5 | 2 | 49 | 300.443 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.67 | 2.48 | -3.97 | 1 | 5 | 0 | 43 | 298.427 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 4.86 | -30.77 | 2 | 5 | 1 | 44 | 299.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 4.05 | -36.9 | 2 | 5 | 1 | 48 | 299.435 | 4 | ↓ |