| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 36 | 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) | 3.29 | 10.69 | -56.36 | 4 | 8 | 1 | 100 | 480.596 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 9.29 | -16.04 | 3 | 8 | 0 | 95 | 479.588 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.29 | 11.14 | -101.62 | 5 | 8 | 2 | 101 | 481.604 | 7 | ↓ |
