| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 31 | 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) | 5.12 | 11.65 | -59.56 | 0 | 5 | -1 | 73 | 449.508 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.54 | -0.5 | -12.28 | 0 | 5 | 0 | 67 | 450.516 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 5.12 | 10.83 | -15.71 | 1 | 5 | 0 | 71 | 450.516 | 4 | ↓ |
