| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 33 | 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) | 4.55 | 8.57 | -15.4 | 0 | 6 | 0 | 65 | 454.404 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 9.31 | -42.32 | 1 | 6 | 1 | 66 | 455.412 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.55 | 11.74 | -119.51 | 2 | 6 | 2 | 67 | 456.42 | 5 | ↓ |
