| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 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) | 4.67 | 12.08 | -65.96 | 1 | 6 | 0 | 74 | 513.432 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 9.79 | -55.96 | 0 | 6 | -1 | 73 | 512.424 | 11 | ↓ |
| Mid Mid (pH 6-8) | 5.12 | 10.92 | -55.6 | 2 | 6 | 1 | 71 | 514.44 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.09 | 11.94 | -57.35 | 1 | 6 | 1 | 68 | 514.44 | 11 | ↓ |
