| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 20th, 2008 | 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) | 2.10 | 5.38 | -154.84 | 10 | 7 | 3 | 130 | 444.729 | 20 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 5.05 | -104.01 | 9 | 7 | 2 | 128 | 443.721 | 20 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 4.72 | -58.62 | 8 | 7 | 1 | 127 | 442.713 | 20 | ↓ |
