| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 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) | 8.16 | 17.04 | -23.03 | 1 | 5 | 1 | 41 | 522.713 | 9 | ↓ |
| Hi High (pH 8-9.5) | 8.16 | 16.4 | -11.86 | 0 | 5 | 0 | 40 | 521.705 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 8.16 | 18.84 | -100.74 | 2 | 5 | 2 | 42 | 523.721 | 9 | ↓ |
