| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2006 | 30 | 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) | 3.77 | 9.09 | -34.33 | 3 | 7 | 1 | 79 | 404.446 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 8.7 | -14.62 | 2 | 7 | 0 | 77 | 403.438 | 4 | ↓ |
