| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 16 | Yes |
Popular Name: 1-methyl-N-[(1S)-1-(4-pyridyl)ethyl]piperidin-4-amine 1-methyl-N-[(1S)-1-(4-pyridyl)et…
| 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) | 1.19 | 5.28 | -36.65 | 2 | 3 | 1 | 29 | 220.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | 4.05 | -43.56 | 2 | 3 | 1 | 33 | 220.34 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.19 | 6.47 | -110.03 | 3 | 3 | 2 | 34 | 221.348 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
