| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2007 | 26 | 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) | 0.57 | 2.2 | -66.03 | 1 | 7 | -1 | 103 | 353.354 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 1.87 | -17.68 | 2 | 7 | 0 | 100 | 354.362 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.01 | 2.17 | -55.52 | 3 | 7 | 1 | 101 | 355.37 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.02 | 2.83 | -47.54 | 2 | 7 | 1 | 98 | 355.37 | 6 | ↓ |
