| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 33 | 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) | 3.10 | 6.9 | -26.57 | 2 | 9 | 0 | 120 | 488.591 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 6.07 | -108.69 | 0 | 9 | -2 | 128 | 486.575 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 6 | -53.77 | 1 | 9 | -1 | 126 | 487.583 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 6.97 | -58.78 | 1 | 9 | -1 | 122 | 487.583 | 7 | ↓ |
