| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 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) | 3.55 | 9.26 | -48.62 | 0 | 9 | -1 | 107 | 512.579 | 12 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 9.1 | -15.4 | 1 | 9 | 0 | 104 | 513.587 | 12 | ↓ |
| Mid Mid (pH 6-8) | 2.97 | 9.52 | -16.63 | 0 | 9 | 0 | 101 | 513.587 | 12 | ↓ |
