| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 15 | 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) | -1.07 | -1.69 | -91.41 | 6 | 5 | 2 | 78 | 216.329 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.07 | -4.38 | -7.77 | 4 | 5 | 0 | 76 | 214.313 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.07 | -2.11 | -31.89 | 5 | 5 | 1 | 77 | 215.321 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.07 | -1.73 | -101.15 | 6 | 5 | 2 | 78 | 216.329 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.07 | -4.01 | -45.75 | 5 | 5 | 1 | 77 | 215.321 | 5 | ↓ |
