| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2009 | 15 | No |
| 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) | -1.05 | -4.65 | -123.67 | 9 | 5 | 2 | 116 | 212.249 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.05 | -5.06 | -52.39 | 8 | 5 | 1 | 114 | 211.241 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.05 | -5.04 | -46.5 | 8 | 5 | 1 | 114 | 211.241 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.