| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 36 | 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) | 4.73 | 13.67 | -52.65 | 1 | 7 | 0 | 77 | 493.648 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.73 | 11.35 | -46.17 | 0 | 7 | -1 | 76 | 492.64 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 4.73 | 12.54 | -48.14 | 2 | 7 | 1 | 75 | 494.656 | 13 | ↓ |
