| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2009 | 32 | 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) | 2.01 | 10.07 | -99.75 | 4 | 7 | 2 | 70 | 443.567 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 7.69 | -49.16 | 3 | 7 | 1 | 69 | 442.559 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 7.71 | -49.9 | 3 | 7 | 1 | 69 | 442.559 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 5.34 | -19.88 | 2 | 7 | 0 | 68 | 441.551 | 9 | ↓ |
