| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2005 | 28 | 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) | 3.11 | 6.61 | -11.78 | 2 | 6 | 0 | 78 | 381.407 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 6.79 | -58.87 | 0 | 6 | -1 | 77 | 380.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 6.73 | -59.48 | 0 | 6 | -1 | 77 | 380.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 7.25 | -51.55 | 1 | 6 | -1 | 81 | 380.399 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 7.36 | -52.02 | 1 | 6 | -1 | 81 | 380.399 | 6 | ↓ |
