| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: [(3R)-3-(diethylamino)pyrrolidin-1-yl]-[(2R)-2-piperidyl]methanone [(3R)-3-(diethylamino)pyrrolidin…
| 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) | 1.25 | 6.04 | -94.71 | 3 | 4 | 2 | 41 | 255.406 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 2.69 | -7.23 | 1 | 4 | 0 | 36 | 253.39 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 4.69 | -39.58 | 2 | 4 | 1 | 37 | 254.398 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
