| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 18 | Yes |
Popular Name: 2-[[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]amino]-1-(1-piperidyl)ethanone 2-[[(1R,8R)-2,3,5,6,7,8-hexahydr…
| 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) | 0.90 | 6.74 | -109.62 | 3 | 4 | 2 | 41 | 253.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 5.8 | -37.87 | 2 | 4 | 1 | 37 | 252.382 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 3.32 | -6.7 | 1 | 4 | 0 | 36 | 251.374 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 4.26 | -41.5 | 2 | 4 | 1 | 40 | 252.382 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
