| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 37 | No |
None
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) | 5.34 | 13.99 | -49.22 | 2 | 6 | 1 | 77 | 497.615 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.34 | 12.63 | -57.41 | 0 | 6 | -1 | 79 | 495.599 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 11.86 | -13.3 | 1 | 6 | 0 | 76 | 496.607 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 14.76 | -47.83 | 1 | 6 | 0 | 80 | 496.607 | 4 | ↓ |
