| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 20 | Yes |
Popular Name: 2-[(1S)-1-[2-(azepan-1-yl)ethylamino]ethyl]benzene-1,4-diol 2-[(1S)-1-[2-(azepan-1-yl)ethyla…
| 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) | 2.94 | 4.11 | -120.73 | 5 | 4 | 2 | 61 | 280.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 2.97 | -36.04 | 4 | 4 | 1 | 57 | 279.404 | 5 | ↓ |
