| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 9th, 2010 | 39 | 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) | 5.73 | 11.45 | -60.49 | 0 | 7 | -1 | 82 | 533.689 | 12 | ↓ |
| Mid Mid (pH 6-8) | 5.73 | 13.71 | -73.23 | 1 | 7 | 0 | 83 | 534.697 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 5.73 | 12.96 | -47.8 | 2 | 7 | 1 | 81 | 535.705 | 12 | ↓ |
