| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 17 | Yes |
Popular Name: 1-[4-[(1-methylpyrrol-2-yl)methylamino]-1-piperidyl]ethanone 1-[4-[(1-methylpyrrol-2-yl)methy…
| 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) | 0.50 | 5.84 | -51.17 | 2 | 4 | 1 | 42 | 236.339 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 4.65 | -11.51 | 1 | 4 | 0 | 37 | 235.331 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
