| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 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) | 4.23 | 12.51 | -18.33 | 2 | 7 | 0 | 89 | 462.575 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.41 | 12.4 | -43.46 | 1 | 7 | -1 | 91 | 461.567 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.57 | 12.16 | -44.72 | 1 | 7 | -1 | 91 | 461.567 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.57 | 12.78 | -32.26 | 3 | 7 | 1 | 94 | 463.583 | 5 | ↓ |
