| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 34 | 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) | 4.51 | 7.81 | -12.99 | 3 | 7 | 0 | 99 | 475.932 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.49 | 7.54 | -55.11 | 1 | 7 | -1 | 98 | 474.924 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.49 | 7.33 | -47.26 | 1 | 7 | -1 | 98 | 474.924 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.51 | 8.8 | -41.97 | 2 | 7 | -1 | 102 | 474.924 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.51 | 8.57 | -48.48 | 2 | 7 | -1 | 102 | 474.924 | 5 | ↓ |
