| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 16 | Yes |
Popular Name: (4-methylpiperazin-1-yl)-[(3R)-1-methyl-3-piperidyl]methanone (4-methylpiperazin-1-yl)-[(3R)-1…
| 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) | 0.36 | 4.17 | -39.05 | 1 | 4 | 1 | 28 | 226.344 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.36 | 1.75 | -6.42 | 0 | 4 | 0 | 27 | 225.336 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 6.52 | -90.66 | 2 | 4 | 2 | 29 | 227.352 | 1 | ↓ |
