| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 16 | Yes |
Popular Name: (1S,2R,4R)-2-[(2S)-2-ethyl-1-piperidyl]-4-methyl-cyclohexanamine (1S,2R,4R)-2-[(2S)-2-ethyl-1-pip…
| 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) | 2.39 | 7.15 | -114.07 | 4 | 2 | 2 | 32 | 226.408 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 4.89 | -38.13 | 3 | 2 | 1 | 31 | 225.4 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 7.05 | -26.41 | 3 | 2 | 1 | 30 | 225.4 | 2 | ↓ |
