| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2006 | 31 | 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) | 2.56 | 3.9 | -15.54 | 3 | 8 | 0 | 108 | 423.469 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 3.53 | -62.47 | 1 | 8 | -1 | 107 | 422.461 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 4.64 | -56.46 | 1 | 8 | -1 | 107 | 422.461 | 6 | ↓ |
