| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2009 | 27 | 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) | 4.48 | 9.54 | -56.06 | 3 | 5 | 1 | 63 | 441.296 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 7.29 | -21.88 | 2 | 5 | 0 | 61 | 440.288 | 6 | ↓ |
