| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 19 | Yes |
Popular Name: 2-[2-dimethylaminoethyl(isobutyl)amino]-1-piperazin-1-yl-ethanone 2-[2-dimethylaminoethyl(isobutyl…
| 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) | 0.14 | 5.46 | -117.01 | 3 | 5 | 2 | 41 | 272.437 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.14 | 2.83 | -37.34 | 2 | 5 | 1 | 40 | 271.429 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | 5.13 | -87.88 | 3 | 5 | 2 | 45 | 272.437 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | 3.82 | -35.59 | 2 | 5 | 1 | 40 | 271.429 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.14 | 6.75 | -191.72 | 4 | 5 | 3 | 46 | 273.445 | 7 | ↓ |
