| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 34 | 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) | 3.12 | 7.45 | -59.38 | 0 | 7 | -1 | 82 | 467.517 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 8.7 | -59.61 | 2 | 7 | 1 | 81 | 469.533 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 9.69 | -54.83 | 1 | 7 | 1 | 77 | 469.533 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 9.78 | -70.61 | 1 | 7 | 0 | 83 | 468.525 | 8 | ↓ |
