| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 3rd, 2006 | 28 | 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) | 4.75 | 11.72 | -13.55 | 1 | 5 | 0 | 63 | 415.324 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.76 | 12.75 | -30.13 | 3 | 5 | 1 | 68 | 416.332 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.75 | 12.19 | -30.19 | 2 | 5 | 1 | 65 | 416.332 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.75 | 12.03 | -35.73 | 2 | 5 | 1 | 65 | 416.332 | 5 | ↓ |
