| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 39 | 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) | 6.24 | 13.22 | -16.11 | 2 | 7 | 0 | 88 | 525.649 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.01 | 12.91 | -59.18 | 0 | 7 | -1 | 87 | 524.641 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.01 | 12.8 | -51.46 | 0 | 7 | -1 | 87 | 524.641 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.24 | 14.22 | -44.54 | 1 | 7 | -1 | 91 | 524.641 | 9 | ↓ |
