| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2008 | 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) | 1.54 | 3.6 | -52.71 | 2 | 9 | 1 | 114 | 460.598 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 1.39 | -24.73 | 1 | 9 | 0 | 113 | 459.59 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 3.16 | -54.04 | 1 | 9 | 0 | 116 | 459.59 | 8 | ↓ |
