| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 26 | Yes |
Popular Name: [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]methylBLAHone [(4aS,8aS)-4a-hydroxy-1,3,4,5,6,…
| 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) | 3.56 | 7.25 | -10.37 | 1 | 4 | 0 | 45 | 352.478 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.56 | 9.06 | -46.4 | 2 | 4 | 1 | 47 | 353.486 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
