| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: 4-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-ethyl-pyridin-2-amine 4-[[(3S)-3-(dimethylamino)pyrrol…
| 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) | 1.18 | 5.01 | -38.2 | 2 | 4 | 1 | 33 | 249.382 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 2.54 | -4.76 | 1 | 4 | 0 | 31 | 248.374 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 4.93 | -37.52 | 2 | 4 | 1 | 33 | 249.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 5.42 | -74.45 | 3 | 4 | 2 | 34 | 250.39 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
