| 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) | 3.04 | 9.12 | -58.72 | 0 | 7 | -1 | 82 | 461.538 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 10.44 | -57.07 | 2 | 7 | 1 | 81 | 463.554 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 11.42 | -60.64 | 1 | 7 | 1 | 77 | 463.554 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 11.52 | -71.5 | 1 | 7 | 0 | 83 | 462.546 | 9 | ↓ |
