| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 20 | Yes |
Popular Name: 2-[(2S)-2-[2-(methylamino)ethyl]-1-piperidyl]-1-(4-methylpiperazin-1-yl)ethanone 2-[(2S)-2-[2-(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) | 0.54 | 5.71 | -102.5 | 3 | 5 | 2 | 45 | 284.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 3.35 | -45.47 | 2 | 5 | 1 | 43 | 283.44 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
