| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: 1-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-2-oxo-ethyl]cyclohexanecarboxylic 1-[2-[(3S)-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) | 1.32 | 9.02 | -77.97 | 1 | 5 | 0 | 65 | 282.384 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.32 | 6.61 | -60.49 | 0 | 5 | -1 | 64 | 281.376 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.32 | 7.02 | -47.56 | 2 | 5 | 1 | 62 | 283.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
