| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 21 | 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) | 3.02 | 7 | -53.9 | 3 | 3 | 1 | 50 | 299.781 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 6.73 | -7.93 | 2 | 3 | 0 | 48 | 298.773 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.02 | 7.5 | -105.28 | 4 | 3 | 2 | 51 | 300.789 | 4 | ↓ |
