| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 20 | Yes |
Popular Name: 2-[1-[[(2S)-4-isobutylmorpholin-2-yl]methyl]-4-piperidyl]ethanamine 2-[1-[[(2S)-4-isobutylmorpholin-…
| 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) | 1.36 | 5.06 | -91.73 | 4 | 4 | 2 | 45 | 285.476 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 2.8 | -43.47 | 3 | 4 | 1 | 43 | 284.468 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.36 | 7.08 | -166.41 | 5 | 4 | 3 | 46 | 286.484 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
