| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | Yes |
Popular Name: (2S)-2-[[(2R,6R)-2,6-dimethylpiperazin-1-yl]methyl]-4-isobutyl-morpholine (2S)-2-[[(2R,6R)-2,6-dimethylpip…
| 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) | 1.28 | 3.22 | -36.03 | 2 | 4 | 1 | 32 | 270.441 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 2.07 | -1.92 | 1 | 4 | 0 | 28 | 269.433 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 5.1 | -82.17 | 3 | 4 | 2 | 34 | 271.449 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
