| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 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) | 4.72 | 10.21 | -58.37 | 0 | 7 | -1 | 92 | 471.514 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.14 | -0.8 | -13.06 | 0 | 7 | 0 | 85 | 472.522 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.72 | 9.38 | -16.32 | 1 | 7 | 0 | 89 | 472.522 | 6 | ↓ |
