| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2009 | 39 | Yes |
| 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) | 1.84 | 9.95 | -42.68 | 4 | 8 | 1 | 98 | 534.725 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 8.72 | -13.08 | 3 | 8 | 0 | 94 | 533.717 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 12.36 | -98.18 | 5 | 8 | 2 | 100 | 535.733 | 9 | ↓ |
