| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2008 | 31 | 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) | 2.60 | 9.97 | -18.83 | 1 | 8 | 0 | 99 | 424.501 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 7.96 | -45.22 | 0 | 8 | -1 | 102 | 423.493 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.60 | 10.33 | -36.6 | 2 | 8 | 1 | 100 | 425.509 | 10 | ↓ |
