| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 19 | Yes |
Popular Name: 4-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]acetyl]benzonitrile 4-[2-[(3R)-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) | 1.39 | 6.72 | -46.37 | 1 | 4 | 1 | 49 | 258.345 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | 4.31 | -9.16 | 0 | 4 | 0 | 47 | 257.337 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
