| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 12th, 2009 | 29 | 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) | 3.14 | 10.79 | -68.98 | 1 | 6 | 0 | 78 | 435.307 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 8.26 | -53.87 | 0 | 6 | -1 | 77 | 434.299 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.14 | 9.84 | -50.52 | 2 | 6 | 1 | 75 | 436.315 | 7 | ↓ |
