| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 32 | 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) | 3.14 | 7.01 | -53.95 | 1 | 7 | -1 | 93 | 455.918 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 7.86 | -129.22 | 0 | 7 | -2 | 96 | 454.91 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 9.34 | -73.73 | 2 | 7 | 0 | 94 | 456.926 | 7 | ↓ |
