| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 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) | 4.71 | 10.06 | -13.73 | 2 | 5 | 0 | 69 | 413.452 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.69 | 10.72 | -51.01 | 0 | 5 | -1 | 68 | 412.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.69 | 10.67 | -57.47 | 0 | 5 | -1 | 68 | 412.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.71 | 11.02 | -36.79 | 1 | 5 | -1 | 72 | 412.444 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.71 | 10.84 | -51.84 | 1 | 5 | -1 | 72 | 412.444 | 5 | ↓ |
