| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 29 | Yes |
Popular Name: (2S)-1-(azepan-1-yl)-3-[3-[(ethyl-(4-pyridylmethyl)amino)methyl]phenoxy]propan-2-ol (2S)-1-(azepan-1-yl)-3-[3-[(ethy…
| 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) | 3.06 | 10.77 | -89.72 | 3 | 5 | 2 | 51 | 399.579 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | 11.05 | -156.84 | 4 | 5 | 3 | 52 | 400.587 | 10 | ↓ |
