| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2010 | 22 | Yes |
Popular Name: N-[2-(azepan-1-yl)ethyl]-3-hydroxy-N-isopropyl-pyridine-2-carboxamide N-[2-(azepan-1-yl)ethyl]-3-hydro…
| 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) | 2.44 | 8.57 | -43.8 | 2 | 5 | 1 | 58 | 306.43 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 9.58 | -64.58 | 1 | 5 | 0 | 61 | 305.422 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.44 | 9.79 | -68.85 | 2 | 5 | 1 | 62 | 306.43 | 5 | ↓ |
