| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2008 | 29 | 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) | 0.62 | 3.55 | -58.23 | 0 | 8 | -1 | 99 | 416.479 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.62 | 5.81 | -72.19 | 1 | 8 | 0 | 100 | 417.487 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.62 | 5.06 | -53.64 | 2 | 8 | 1 | 97 | 418.495 | 6 | ↓ |
