| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2008 | 31 | 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) | 5.63 | 13.08 | -43.47 | 1 | 4 | -1 | 68 | 413.541 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.09 | 13.44 | -10.56 | 2 | 4 | 0 | 62 | 414.549 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.63 | 13.08 | -43.47 | 1 | 4 | -1 | 68 | 413.541 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.63 | 10.84 | -12.42 | 2 | 4 | 0 | 65 | 414.549 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.63 | 10.82 | -11.64 | 2 | 4 | 0 | 65 | 414.549 | 7 | ↓ |
