| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 30 | 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) | 3.32 | 12.81 | -42.76 | 2 | 8 | 1 | 69 | 414.578 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 10.45 | -10.25 | 1 | 8 | 0 | 68 | 413.57 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.32 | 13.13 | -94.95 | 3 | 8 | 2 | 70 | 415.586 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.32 | 13.11 | -96.22 | 3 | 8 | 2 | 70 | 415.586 | 4 | ↓ |
