| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: (1R,8R)-N-[2-(2-pyridyl)ethyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (1R,8R)-N-[2-(2-pyridyl)ethyl]-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) | 1.27 | 6.13 | -32.79 | 2 | 3 | 1 | 29 | 232.351 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 3.65 | -4.09 | 1 | 3 | 0 | 28 | 231.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 4.57 | -39.94 | 2 | 3 | 1 | 33 | 232.351 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.27 | 6.49 | -74.84 | 3 | 3 | 2 | 31 | 233.359 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
