| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 33 | 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) | 3.39 | 5.73 | -21.26 | 4 | 9 | 0 | 129 | 511.332 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.39 | 6.65 | -71.58 | 3 | 9 | -1 | 132 | 510.324 | 7 | ↓ |
