| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2009 | 25 | 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) | 2.02 | 4.74 | -59.7 | 4 | 8 | 1 | 101 | 392.263 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 2.56 | -28.47 | 3 | 8 | 0 | 100 | 391.255 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 3.74 | -47.31 | 3 | 8 | 0 | 107 | 391.255 | 8 | ↓ |
