| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 33 | 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) | 3.58 | 9.24 | -30.81 | 1 | 8 | 0 | 88 | 469.542 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 8.3 | -48.25 | 0 | 8 | -1 | 94 | 468.534 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.58 | 11.59 | -64.87 | 2 | 8 | 1 | 89 | 470.55 | 7 | ↓ |
