| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 1st, 2010 | 18 | 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) | 2.18 | 5.04 | -12.36 | 1 | 4 | 0 | 63 | 239.23 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 6.03 | -55.75 | 0 | 4 | -1 | 66 | 238.222 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 5.5 | -47.7 | 2 | 4 | 1 | 65 | 240.238 | 1 | ↓ |
