| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 16 | No |
Popular Name: 1-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]cyclopentanecarbaldehyde 1-[[(3S)-3-(dimethylamino)pyrrol…
| 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) | 1.80 | 5.74 | -39.14 | 1 | 3 | 1 | 25 | 225.356 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 3.36 | -4.24 | 0 | 3 | 0 | 24 | 224.348 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.80 | 7.7 | -117.3 | 2 | 3 | 2 | 26 | 226.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
