| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 33 | No |
| 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) | 4.43 | 10.52 | -60.69 | 0 | 7 | -1 | 96 | 459.865 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 10.93 | -52.87 | 1 | 7 | 0 | 97 | 460.873 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.43 | 9.77 | -13.47 | 1 | 7 | 0 | 93 | 460.873 | 5 | ↓ |
