In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (7R,8S)-7-[(3S)-3-ethoxy-1-piperidyl]-N-methyl-1,4-dioxaspiro[4.5]decan-8-amine (7R,8S)-7-[(3S)-3-ethoxy-1-piper…
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) | 1.40 | 4.07 | -36.59 | 2 | 5 | 1 | 48 | 299.435 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 3.25 | -3.53 | 1 | 5 | 0 | 43 | 298.427 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 5.08 | -33.48 | 2 | 5 | 1 | 44 | 299.435 | 4 | ↓ |