| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 27 | Yes |
Popular Name: (3R,4R)-4-(azepan-1-yl)-1-[1-(2-pyridylmethyl)-4-piperidyl]piperidin-3-ol (3R,4R)-4-(azepan-1-yl)-1-[1-(2-…
| 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) | 1.91 | 7.32 | -79.65 | 3 | 5 | 2 | 45 | 374.573 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 5.08 | -33.77 | 2 | 5 | 1 | 44 | 373.565 | 4 | ↓ |
