| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 27 | 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) | 3.68 | 5.09 | -12.85 | 3 | 6 | 0 | 89 | 363.417 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 5.55 | -54.01 | 1 | 6 | -1 | 88 | 362.409 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 5.51 | -53.83 | 1 | 6 | -1 | 88 | 362.409 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.68 | 5.86 | -36.6 | 2 | 6 | -1 | 92 | 362.409 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 5.67 | -51.38 | 2 | 6 | -1 | 92 | 362.409 | 5 | ↓ |
