| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2006 | 29 | 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) | 2.91 | 2.45 | -17.09 | 4 | 7 | 0 | 110 | 413.861 | 5 | ↓ |
| Ref Reference (pH 7) | 2.91 | 2.4 | -13.16 | 4 | 7 | 0 | 110 | 413.861 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 2.24 | -55.91 | 2 | 7 | -1 | 109 | 412.853 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 2.21 | -51.02 | 2 | 7 | -1 | 109 | 412.853 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.91 | 3.2 | -46.64 | 3 | 7 | -1 | 113 | 412.853 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 3.17 | -50.9 | 3 | 7 | -1 | 113 | 412.853 | 5 | ↓ |
