| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 14 | Yes |
Popular Name: 1-[1-(azetidin-3-yl)-4-piperidyl]-N,N-dimethyl-methanamine 1-[1-(azetidin-3-yl)-4-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) | 0.78 | 5.81 | -180.24 | 4 | 3 | 3 | 25 | 200.35 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 1.95 | -35.01 | 2 | 3 | 1 | 20 | 198.334 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 3.62 | -80.55 | 3 | 3 | 2 | 24 | 199.342 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 4.14 | -90.69 | 3 | 3 | 2 | 21 | 199.342 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
