| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 18 | Yes |
Popular Name: (1R,4aS,8aR)-2-methyl-1-(3-pyridyl)-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol (1R,4aS,8aR)-2-methyl-1-(3-pyrid…
| 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) | 2.03 | 5.02 | -40.18 | 2 | 3 | 1 | 38 | 247.362 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 5.47 | -97.99 | 3 | 3 | 2 | 39 | 248.37 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
