| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 32 | Yes |
| 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) | 5.73 | 12.52 | -34 | 1 | 4 | 1 | 26 | 455.981 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.73 | 12.03 | -35.99 | 1 | 4 | 1 | 26 | 455.981 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.73 | 10.2 | -5.92 | 0 | 4 | 0 | 25 | 454.973 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
