| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 35 | 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) | 3.10 | 10.74 | -73.07 | 1 | 8 | 0 | 93 | 480.561 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 8.51 | -60.05 | 0 | 8 | -1 | 91 | 479.553 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 9.58 | -59.41 | 2 | 8 | 1 | 90 | 481.569 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 10.61 | -63.41 | 1 | 8 | 1 | 87 | 481.569 | 10 | ↓ |
