| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 36 | 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) | 3.76 | 9.91 | -82.92 | 1 | 8 | 0 | 96 | 507.612 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 7.61 | -67.25 | 0 | 8 | -1 | 95 | 506.604 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 9.18 | -55.76 | 2 | 8 | 1 | 93 | 508.62 | 9 | ↓ |
