| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 29 | 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) | 1.11 | 5.21 | -50.51 | 4 | 8 | 1 | 108 | 417.511 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 4.13 | -52.2 | 3 | 8 | 0 | 114 | 416.503 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 2.29 | -18.66 | 3 | 8 | 0 | 110 | 416.503 | 4 | ↓ |
