| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | Yes |
Popular Name: 1-ethyl-3-[(2S)-2-[2-(methylamino)ethyl]-1-piperidyl]pyrazin-2-one 1-ethyl-3-[(2S)-2-[2-(methylamin…
| 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) | 1.30 | 7.18 | -43.81 | 2 | 5 | 1 | 55 | 265.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.30 | 6.32 | -96.95 | 3 | 5 | 2 | 56 | 266.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
