| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: 1-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]acetyl]piperidin-4-one 1-[2-[(3S)-3-(dimethylamino)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) | -0.58 | 4.17 | -46.25 | 1 | 5 | 1 | 45 | 254.354 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.58 | 1.77 | -11 | 0 | 5 | 0 | 44 | 253.346 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.58 | 4.05 | -45.66 | 1 | 5 | 1 | 45 | 254.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
