| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 17 | Yes |
Popular Name: (2R)-2-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]cyclopentanone (2R)-2-[(3S)-3-(1-piperidyl)pyrr…
| 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) | 1.46 | 8.55 | -108.87 | 2 | 3 | 2 | 26 | 238.375 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 3.81 | -4.72 | 0 | 3 | 0 | 24 | 236.359 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 6.37 | -34.24 | 1 | 3 | 1 | 25 | 237.367 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 5.99 | -29.93 | 1 | 3 | 1 | 25 | 237.367 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
