| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 35 | No |
None
None
| 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) | 3.52 | 8.49 | -53.73 | 4 | 8 | 1 | 105 | 489.474 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 7.64 | -43.18 | 3 | 8 | 0 | 111 | 488.466 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.52 | 6.29 | -21.13 | 3 | 8 | 0 | 104 | 488.466 | 10 | ↓ |
