| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2011 | 14 | Yes |
Popular Name: (2S)-2-[(4R)-4-ethylazepan-1-yl]-N-methyl-propan-1-amine (2S)-2-[(4R)-4-ethylazepan-1-yl]…
| 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) | 2.56 | 7.06 | -110.6 | 3 | 2 | 2 | 21 | 200.37 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 5.48 | -34.98 | 2 | 2 | 1 | 20 | 199.362 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 5.63 | -28.79 | 2 | 2 | 1 | 16 | 199.362 | 4 | ↓ |
