| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 21 | Yes |
Popular Name: 2-[4-[3-(hydroxymethyl)-2-quinolyl]piperazin-1-yl]ethanol 2-[4-[3-(hydroxymethyl)-2-quinol…
| 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) | 0.91 | 1.41 | -25.14 | 3 | 5 | 1 | 61 | 288.371 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 0.97 | -9.19 | 2 | 5 | 0 | 60 | 287.363 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 3.27 | -37.98 | 3 | 5 | 1 | 61 | 288.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.91 | 3.72 | -86.55 | 4 | 5 | 2 | 62 | 289.379 | 4 | ↓ |
