| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | 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) | 1.88 | 5.74 | -102.14 | 4 | 4 | 2 | 54 | 275.396 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 5.32 | -50.08 | 3 | 4 | 1 | 53 | 274.388 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 5.34 | -23.81 | 3 | 4 | 1 | 53 | 274.388 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 4.91 | -5.93 | 2 | 4 | 0 | 51 | 273.38 | 2 | ↓ |
