| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2009 | 31 | 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) | 3.22 | 6.49 | -41.43 | 2 | 7 | 1 | 77 | 443.907 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 4.89 | -43.28 | 0 | 7 | -1 | 78 | 441.891 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 6.37 | -42.43 | 2 | 7 | 1 | 77 | 443.907 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 4.13 | -9.42 | 1 | 7 | 0 | 75 | 442.899 | 3 | ↓ |
