| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 34 | 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) | 2.81 | 9.14 | -52.28 | 2 | 8 | 1 | 78 | 474.622 | 15 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 6.75 | -11.64 | 1 | 8 | 0 | 76 | 473.614 | 15 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 8.98 | -47.09 | 2 | 8 | 1 | 78 | 474.622 | 15 | ↓ |
