| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2008 | 30 | 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) | 3.15 | 9.47 | -41.98 | 0 | 8 | -1 | 115 | 409.418 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 10.51 | -23.16 | 0 | 8 | 0 | 110 | 410.426 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 8.65 | -13.92 | 1 | 8 | 0 | 113 | 410.426 | 7 | ↓ |
