| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 34 | 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) | 3.34 | 8.26 | -57.45 | 1 | 8 | -1 | 116 | 492.92 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 9.2 | -107.4 | 0 | 8 | -2 | 119 | 491.912 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 6.97 | -25.07 | 2 | 8 | 0 | 113 | 493.928 | 5 | ↓ |
