| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 16 | Yes |
Popular Name: N-[(1-methylpyrrol-2-yl)methyl]-2-(1-piperidyl)ethanamine N-[(1-methylpyrrol-2-yl)methyl]-…
None
| 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) | 1.66 | 7.83 | -118.55 | 3 | 3 | 2 | 26 | 223.364 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 4.25 | -3.24 | 1 | 3 | 0 | 20 | 221.348 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 6.47 | -35.32 | 2 | 3 | 1 | 21 | 222.356 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 5.62 | -40.65 | 2 | 3 | 1 | 25 | 222.356 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
