| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2008 | 30 | 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) | 4.84 | 11.01 | -38.49 | 2 | 6 | 1 | 72 | 444.65 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.77 | 8.04 | -14.03 | 1 | 6 | 0 | 74 | 443.642 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.91 | 7.64 | -43.5 | 0 | 6 | -1 | 77 | 442.634 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.91 | 9.92 | -41.47 | 1 | 6 | 0 | 79 | 443.642 | 5 | ↓ |
