| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 35 | No |
| 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) | 4.70 | 10.86 | -15.67 | 1 | 6 | 0 | 80 | 468.553 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 11.52 | -24.71 | 0 | 6 | 0 | 77 | 468.553 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 5.15 | 10.82 | -53.78 | 2 | 6 | 1 | 81 | 469.561 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.12 | 11.81 | -52.93 | 1 | 6 | 1 | 78 | 469.561 | 9 | ↓ |
