| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (3R,4R)-N4-ethyl-N3-(1-ethyl-4-piperidyl)-N3-methyl-heptane-3,4-diamine (3R,4R)-N4-ethyl-N3-(1-ethyl-4-p…
| 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) | 3.59 | 7.9 | -83.34 | 3 | 3 | 2 | 24 | 285.52 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 7.49 | -107.42 | 3 | 3 | 2 | 24 | 285.52 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 5.92 | -34.16 | 2 | 3 | 1 | 20 | 284.512 | 9 | ↓ |
