| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2010 | 22 | 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) | 2.77 | 7.72 | -42.37 | 1 | 4 | 1 | 28 | 310.506 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 5.26 | -6.79 | 0 | 4 | 0 | 27 | 309.498 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.77 | 9.68 | -116.4 | 2 | 4 | 2 | 29 | 311.514 | 5 | ↓ |
