| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2009 | 21 | Yes |
Popular Name: 2-[2-[(1S)-1-(methylamino)ethyl]phenoxy]-1-(4-methylpiperazin-1-yl)ethanone 2-[2-[(1S)-1-(methylamino)ethyl]…
| 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) | 1.31 | 5.51 | -40.51 | 2 | 5 | 1 | 49 | 292.403 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 4.29 | -11.47 | 1 | 5 | 0 | 45 | 291.395 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 7.86 | -88.45 | 3 | 5 | 2 | 51 | 293.411 | 5 | ↓ |
