| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: 2-[1-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-2-oxo-ethyl]cyclohexyl]acetic 2-[1-[2-[(3S)-3-(dimethylamino)p…
| 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) | 1.59 | 8.72 | -67.64 | 1 | 5 | 0 | 65 | 296.411 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.59 | 6.31 | -49.89 | 0 | 5 | -1 | 64 | 295.403 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.59 | 6.74 | -40.4 | 2 | 5 | 1 | 62 | 297.419 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
