| 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) | 2.89 | 5.58 | -15.75 | 2 | 6 | 0 | 78 | 367.38 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 6.04 | -54.18 | 0 | 6 | -1 | 77 | 366.372 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 6.23 | -56.7 | 0 | 6 | -1 | 77 | 366.372 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 6.58 | -39.44 | 1 | 6 | -1 | 81 | 366.372 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 6.35 | -54.86 | 1 | 6 | -1 | 81 | 366.372 | 5 | ↓ |
