| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 31 | 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) | 4.87 | 9.54 | -10.53 | 2 | 6 | 0 | 78 | 415.493 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.64 | 9.41 | -53.76 | 0 | 6 | -1 | 77 | 414.485 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.64 | 9.35 | -53.15 | 0 | 6 | -1 | 77 | 414.485 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.87 | 10.36 | -47.18 | 1 | 6 | -1 | 81 | 414.485 | 7 | ↓ |
