| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 16 | Yes |
Popular Name: [(3S)-3-(dimethylamino)pyrrolidin-1-yl]-[(2S)-morpholin-2-yl]methanone [(3S)-3-(dimethylamino)pyrrolidi…
| 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) | -0.92 | 3.54 | -117.13 | 3 | 5 | 2 | 51 | 229.324 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.92 | -0.23 | -9.47 | 1 | 5 | 0 | 45 | 227.308 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.92 | 2.18 | -50.84 | 2 | 5 | 1 | 46 | 228.316 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
