| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2008 | 28 | Yes |
Popular Name: (2S)-1-(azepan-1-yl)-3-[3-[(methyl-(2-pyridylmethyl)amino)methyl]phenoxy]propan-2-ol (2S)-1-(azepan-1-yl)-3-[3-[(meth…
| 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 | 10.34 | -85.09 | 3 | 5 | 2 | 51 | 385.552 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 10.58 | -163.35 | 4 | 5 | 3 | 52 | 386.56 | 9 | ↓ |
