| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 19 | Yes |
Popular Name: (4S)-1-[3-(dimethylamino)propyl]-4-(piperazin-1-ylmethyl)pyrrolidin-2-one (4S)-1-[3-(dimethylamino)propyl]…
| 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) | -0.21 | 4.48 | -88.1 | 3 | 5 | 2 | 45 | 270.421 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.21 | 3.12 | -40.5 | 2 | 5 | 1 | 40 | 269.413 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
