| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 20 | Yes |
Popular Name: 4-[methyl-(1-methyl-4-piperidyl)amino]-1-piperazin-1-yl-butan-1-one 4-[methyl-(1-methyl-4-piperidyl)…
| 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) | -0.05 | 4.55 | -91.59 | 3 | 5 | 2 | 45 | 284.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 3.33 | -40.87 | 2 | 5 | 1 | 40 | 283.44 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 3.33 | -42.69 | 2 | 5 | 1 | 40 | 283.44 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 4.62 | -95.56 | 3 | 5 | 2 | 45 | 284.448 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.05 | 7.04 | -170.4 | 4 | 5 | 3 | 46 | 285.456 | 5 | ↓ |
