| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2006 | 27 | 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) | 4.76 | 8.22 | -13.36 | 2 | 6 | 0 | 85 | 385.803 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.94 | 6.15 | -55.3 | 1 | 6 | -1 | 91 | 384.795 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.76 | 9.22 | -54.49 | 1 | 6 | -1 | 88 | 384.795 | 6 | ↓ |
