| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 31 | 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) | 3.41 | 7.29 | -68.57 | 3 | 6 | 0 | 97 | 483.779 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 5.8 | -54.46 | 2 | 6 | -1 | 93 | 482.771 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.86 | 6.31 | -59.1 | 4 | 6 | 1 | 94 | 484.787 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 7.3 | -55.1 | 3 | 6 | 1 | 91 | 484.787 | 9 | ↓ |
