| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 14 | Yes |
| 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) | 0.48 | 4.55 | -79.11 | 3 | 3 | 2 | 24 | 201.358 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.48 | 3.32 | -33.51 | 2 | 3 | 1 | 20 | 200.35 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.48 | 5.29 | -89.26 | 3 | 3 | 2 | 21 | 201.358 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.48 | 6.59 | -175.29 | 4 | 3 | 3 | 25 | 202.366 | 5 | ↓ |
