| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 17 | Yes |
Popular Name: 1-isopropyl-N-[(1-methylpyrrol-2-yl)methyl]piperidin-4-amine 1-isopropyl-N-[(1-methylpyrrol-2…
| 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) | 1.81 | 6.81 | -37.14 | 2 | 3 | 1 | 21 | 236.383 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 8.09 | -108.1 | 3 | 3 | 2 | 26 | 237.391 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 5.84 | -40.13 | 2 | 3 | 1 | 25 | 236.383 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
