| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: 2-[[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]amino]-1-pyrrolidin-1-yl-ethanone 2-[[(1S,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) | 0.39 | 5.6 | -107.83 | 3 | 4 | 2 | 41 | 239.363 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 4.43 | -37.14 | 2 | 4 | 1 | 37 | 238.355 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 1.92 | -8.27 | 1 | 4 | 0 | 36 | 237.347 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 3.1 | -41.21 | 2 | 4 | 1 | 40 | 238.355 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
