| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 28th, 2009 | 42 | No |
None
| 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) | 5.51 | 16.58 | -58.01 | 2 | 6 | 1 | 68 | 556.686 | 11 | ↓ |
| Mid Mid (pH 6-8) | 5.51 | 15.16 | -15.39 | 1 | 6 | 0 | 64 | 555.678 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 5.51 | 17.02 | -110.39 | 3 | 6 | 2 | 70 | 557.694 | 11 | ↓ |
