| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 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) | 3.12 | 6.57 | -10.9 | 1 | 7 | 0 | 77 | 436.508 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 7.32 | -50.66 | 0 | 7 | -1 | 80 | 435.5 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 9.57 | -35.78 | 1 | 7 | 0 | 81 | 436.508 | 9 | ↓ |
