| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 37 | 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) | 6.51 | 12.04 | -11.47 | 2 | 7 | 0 | 88 | 505.659 | 12 | ↓ |
| Hi High (pH 8-9.5) | 6.28 | 12.6 | -45.78 | 0 | 7 | -1 | 87 | 504.651 | 12 | ↓ |
| Hi High (pH 8-9.5) | 6.28 | 12.37 | -54.25 | 0 | 7 | -1 | 87 | 504.651 | 12 | ↓ |
| Hi High (pH 8-9.5) | 6.51 | 13.13 | -39.97 | 1 | 7 | -1 | 91 | 504.651 | 12 | ↓ |
