| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 37 | 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) | 2.40 | 5.1 | -111.81 | 1 | 10 | -2 | 150 | 546.602 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 4.77 | -220.15 | 0 | 10 | -3 | 152 | 545.594 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 4.5 | -27.3 | 1 | 10 | 0 | 144 | 547.61 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 4.04 | -27.23 | 1 | 10 | 0 | 144 | 547.61 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.40 | 4.93 | -56.19 | 2 | 10 | -1 | 148 | 547.61 | 5 | ↓ |
