| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 22 | No |
Popular Name: 3-[(1S,2S)-2-(4-methylpiperazin-1-yl)cyclohexoxy]benzaldehyde 3-[(1S,2S)-2-(4-methylpiperazin-…
| 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) | 3.07 | 7.53 | -40.75 | 1 | 4 | 1 | 34 | 303.426 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 5.06 | -6.4 | 0 | 4 | 0 | 33 | 302.418 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 7.36 | -38.86 | 1 | 4 | 1 | 34 | 303.426 | 4 | ↓ |
