| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 19 | Yes |
Popular Name: 1-[(3R)-3-imidazol-1-yl-1-piperidyl]-2-[isopropyl(methyl)amino]ethanone 1-[(3R)-3-imidazol-1-yl-1-piperi…
| 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) | 0.44 | 9.18 | -80.02 | 2 | 5 | 2 | 44 | 266.389 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 6.25 | -12.24 | 0 | 5 | 0 | 41 | 264.373 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 8.46 | -43.43 | 1 | 5 | 1 | 43 | 265.381 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
