| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 26 | 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) | 2.70 | 7.56 | -54.61 | 3 | 5 | 1 | 66 | 369.514 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 5.1 | -46.83 | 2 | 5 | 0 | 69 | 368.506 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 6.2 | -10.59 | 2 | 5 | 0 | 61 | 368.506 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.70 | 9.84 | -98.75 | 4 | 5 | 2 | 67 | 370.522 | 6 | ↓ |
