| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 36 | 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) | 4.59 | 13.91 | -50.62 | 1 | 9 | 0 | 120 | 495.576 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 11.61 | -37.8 | 0 | 9 | -1 | 119 | 494.568 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 4.59 | 12.78 | -56.43 | 2 | 9 | 1 | 117 | 496.584 | 13 | ↓ |
