| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 29 | 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) | 1.93 | 9.26 | -32.22 | 3 | 7 | 0 | 114 | 467.36 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 7.63 | -48.51 | 2 | 7 | -1 | 117 | 466.352 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 7.73 | -45.91 | 2 | 7 | -1 | 110 | 466.352 | 7 | ↓ |
