| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 23 | Yes |
Popular Name: 2-[2-[(1S,2R)-2-(4-methylpiperazin-1-yl)cyclohexoxy]phenyl]ethanamine 2-[2-[(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) | 2.24 | 6.85 | -93.07 | 4 | 4 | 2 | 45 | 319.493 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.24 | 4.38 | -44.66 | 3 | 4 | 1 | 43 | 318.485 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.24 | 6.67 | -101.56 | 4 | 4 | 2 | 45 | 319.493 | 5 | ↓ |
