| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: 4-[[(3S)-3-(diethylamino)pyrrolidin-1-yl]methyl]-N-propyl-pyridin-2-amine 4-[[(3S)-3-(diethylamino)pyrroli…
| 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) | 2.43 | 7.09 | -38.43 | 2 | 4 | 1 | 33 | 291.463 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 4.6 | -3.7 | 1 | 4 | 0 | 31 | 290.455 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 6.71 | -36.9 | 2 | 4 | 1 | 33 | 291.463 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 7.19 | -74.75 | 3 | 4 | 2 | 34 | 292.471 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
