| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 38 | 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) | 3.82 | 10.7 | -74.08 | 2 | 8 | 0 | 104 | 516.594 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 8.16 | -62.37 | 1 | 8 | -1 | 102 | 515.586 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 10.88 | -50.51 | 3 | 8 | 1 | 101 | 517.602 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 11.23 | -53.61 | 2 | 8 | 1 | 98 | 517.602 | 10 | ↓ |
