| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 17 | Yes |
Popular Name: [4-[2-(methylamino)ethyl]-1-piperidyl]-(1H-triazol-4-yl)methanone [4-[2-(methylamino)ethyl]-1-pipe…
| 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) | 0.47 | 2.53 | -45.97 | 3 | 6 | 1 | 78 | 238.315 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.47 | 2.51 | -64.78 | 2 | 6 | 0 | 77 | 237.307 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
