| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 33 | 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) | 4.46 | 7.32 | -24.07 | 1 | 8 | 0 | 96 | 485.635 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.28 | 6.42 | -49.5 | 0 | 8 | -1 | 102 | 484.627 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.46 | 9.71 | -64.56 | 2 | 8 | 1 | 97 | 486.643 | 7 | ↓ |
