| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | No |
Popular Name: 2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]quinoline-3-carbaldehyde 2-[(3S)-3-(dimethylamino)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) | 2.25 | 8.94 | -42.46 | 1 | 4 | 1 | 38 | 270.356 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 6.55 | -8.2 | 0 | 4 | 0 | 36 | 269.348 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
