| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 34 | 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) | 3.35 | 10.52 | -62.64 | 2 | 8 | 0 | 107 | 487.984 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 8.27 | -56.33 | 1 | 8 | -1 | 106 | 486.976 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.35 | 9.8 | -51.53 | 3 | 8 | 1 | 104 | 488.992 | 10 | ↓ |
