| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2007 | 33 | 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) | 4.92 | 11.71 | -56.75 | 0 | 5 | -1 | 73 | 459.953 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.37 | 1.13 | -18.18 | 1 | 5 | 0 | 70 | 460.961 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.37 | 12.18 | -46.8 | 2 | 5 | 1 | 72 | 461.969 | 5 | ↓ |
