| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2010 | 34 | 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) | 4.53 | 14.14 | -16.18 | 2 | 8 | 0 | 90 | 461.566 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 14.59 | -56.97 | 3 | 8 | 1 | 95 | 462.574 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.56 | 13.18 | -45.52 | 2 | 8 | -1 | 96 | 460.558 | 8 | ↓ |
