| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 29 | No |
None
| 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) | 2.18 | 5.8 | -71.68 | 3 | 8 | 0 | 104 | 395.463 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 3.48 | -54 | 2 | 8 | -1 | 102 | 394.455 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 8.32 | -51.03 | 4 | 8 | 1 | 100 | 396.471 | 8 | ↓ |
