| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 25 | 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) | 3.88 | 12.66 | -13.42 | 0 | 5 | 0 | 46 | 351.841 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.88 | 13.93 | -48.12 | 2 | 5 | 0 | 49 | 353.857 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.88 | 13.18 | -32.11 | 1 | 5 | 1 | 48 | 352.849 | 3 | ↓ |
