| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | Yes |
Popular Name: 4-[(3R,6S)-6-ethyl-3-methyl-1,5-diazocan-1-yl]-N-isopropyl-N-methyl-butan-1-amine 4-[(3R,6S)-6-ethyl-3-methyl-1,5-…
| 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) | 3.12 | 10.32 | -172.68 | 4 | 3 | 3 | 25 | 286.528 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 9.52 | -89.66 | 3 | 3 | 2 | 21 | 285.52 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 8.94 | -75.41 | 3 | 3 | 2 | 24 | 285.52 | 7 | ↓ |
