| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2R,4S)-N1-ethyl-N2-methyl-4-propyl-N2-(2-pyridylmethyl)cyclohexane-1,2-diamine (1S,2R,4S)-N1-ethyl-N2-methyl-4-…
| 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) | 3.37 | 8.18 | -36 | 2 | 3 | 1 | 33 | 290.475 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 9.59 | -32.07 | 2 | 3 | 1 | 29 | 290.475 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 8.88 | -85.55 | 3 | 3 | 2 | 34 | 291.483 | 7 | ↓ |
