| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 24th, 2010 | 30 | 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) | 3.01 | 2.71 | -58.94 | 2 | 8 | -1 | 121 | 473.255 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | 3.62 | -116.31 | 1 | 8 | -2 | 124 | 472.247 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.01 | 1.94 | -15.62 | 3 | 8 | 0 | 118 | 474.263 | 5 | ↓ |
