| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 19 | Yes |
Popular Name: 2-[[[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]methyl]-4-chloro-phenol 2-[[[(1S,8aR)-1,2,3,5,6,7,8,8a-o…
| 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) | 3.13 | 5.23 | -34.48 | 3 | 3 | 1 | 37 | 281.807 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 2.98 | -3.21 | 2 | 3 | 0 | 35 | 280.799 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 4.83 | -28.3 | 2 | 3 | 0 | 43 | 280.799 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.14 | 6.39 | -114.78 | 4 | 3 | 2 | 41 | 282.815 | 3 | ↓ |
