| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 20 | No |
Popular Name: 2-(2-chloro-4-hydroxy-phenyl)-4H-isoquinoline-1,3-dione 2-(2-chloro-4-hydroxy-phenyl)-4H…
| 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) | 2.51 | 5.77 | -13.06 | 1 | 4 | 0 | 58 | 287.702 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 6.53 | -52.9 | 0 | 4 | -1 | 60 | 286.694 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
