| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2010 | 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) | 1.16 | 1.99 | -55.23 | 2 | 8 | -1 | 123 | 482.332 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 2.91 | -106.52 | 1 | 8 | -2 | 126 | 481.324 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.16 | 1.1 | -13.84 | 3 | 8 | 0 | 120 | 483.34 | 6 | ↓ |
