| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 24 | Yes |
Popular Name: (1R,9aR)-1-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,3,4,6,7,8,9,9a-octahydroquinolizin-1-ol (1R,9aR)-1-[[2-(1H-indol-3-yl)et…
| 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) | 2.46 | 7.86 | -111.36 | 5 | 4 | 2 | 57 | 329.488 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 5.94 | -47.24 | 4 | 4 | 1 | 56 | 328.48 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
