In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (8R,9S)-9-[(2S)-2-ethylpyrrolidin-1-yl]-N-propyl-1,4-dioxaspiro[4.5]decan-8-amine (8R,9S)-9-[(2S)-2-ethylpyrrolidi…
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) | 2.80 | 6.99 | -30.18 | 2 | 4 | 1 | 35 | 297.463 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 5.51 | -2.13 | 1 | 4 | 0 | 34 | 296.455 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 6.34 | -33.6 | 2 | 4 | 1 | 38 | 297.463 | 5 | ↓ |