| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 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) | 3.56 | 6.59 | -10.94 | 2 | 7 | 0 | 88 | 407.47 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 6.37 | -57.86 | 0 | 7 | -1 | 87 | 406.462 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 7.1 | -56.69 | 0 | 7 | -1 | 87 | 406.462 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 7.4 | -50.47 | 1 | 7 | -1 | 91 | 406.462 | 6 | ↓ |
