| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 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) | 3.14 | 4.61 | -13.8 | 3 | 6 | 0 | 89 | 383.835 | 4 | ↓ |
| Ref Reference (pH 7) | 3.14 | 4.56 | -10.18 | 3 | 6 | 0 | 89 | 383.835 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 4.35 | -53.19 | 1 | 6 | -1 | 88 | 382.827 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 4.92 | -51.48 | 1 | 6 | -1 | 88 | 382.827 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 5.38 | -44.32 | 2 | 6 | -1 | 92 | 382.827 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 5.33 | -48.08 | 2 | 6 | -1 | 92 | 382.827 | 4 | ↓ |
