| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 23 | Yes |
Popular Name: 2-[3-[(1S,2R)-2-(4-methylpiperazin-1-yl)cyclohexoxy]phenyl]ethanamine 2-[3-[(1S,2R)-2-(4-methylpiperaz…
| 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) | 2.26 | 6.79 | -97.91 | 4 | 4 | 2 | 45 | 319.493 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 6.61 | -96 | 4 | 4 | 2 | 45 | 319.493 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 4.32 | -50.64 | 3 | 4 | 1 | 43 | 318.485 | 5 | ↓ |
