| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 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) | 1.31 | 7.65 | -61.35 | 0 | 8 | -1 | 105 | 417.397 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | -1.17 | -22.59 | 0 | 8 | 0 | 98 | 418.405 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.31 | -0.96 | -55.06 | 2 | 8 | 1 | 103 | 419.413 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.72 | -1.06 | -66.37 | 1 | 8 | 1 | 100 | 419.413 | 5 | ↓ |
