| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 31 | 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) | 3.95 | 15.23 | -66.46 | 1 | 5 | -1 | 82 | 467.979 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 15.19 | -64.47 | 1 | 5 | -1 | 82 | 467.979 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.95 | 15.16 | -89.49 | 2 | 5 | 0 | 84 | 468.987 | 6 | ↓ |
