| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 28 | Yes |
None
| 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) | 3.42 | 4.12 | -16.59 | 3 | 7 | 0 | 99 | 444.285 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 3.2 | -48.72 | 1 | 7 | -1 | 98 | 443.277 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 4.9 | -56.87 | 2 | 7 | -1 | 102 | 443.277 | 4 | ↓ |
