| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 28 | Yes |
Popular Name: 2-[[(3R)-1-isopropyl-3-piperidyl]methyl-methyl-amino]ethylBLAHone 2-[[(3R)-1-isopropyl-3-piperidyl…
| 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) | 2.32 | 9.78 | -40.83 | 1 | 5 | 1 | 31 | 385.576 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 10.3 | -42.49 | 1 | 5 | 1 | 31 | 385.576 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 11.92 | -103.23 | 2 | 5 | 2 | 32 | 386.584 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
