| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 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 | 10.47 | -13.54 | 2 | 5 | 0 | 69 | 413.452 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.69 | 10.71 | -57.52 | 0 | 5 | -1 | 68 | 412.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.69 | 10.92 | -43.58 | 0 | 5 | -1 | 68 | 412.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.71 | 11.37 | -41.31 | 1 | 5 | -1 | 72 | 412.444 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.71 | 11.23 | -51.96 | 1 | 5 | -1 | 72 | 412.444 | 5 | ↓ |
