| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 7th, 2010 | 37 | 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) | 3.71 | 10.12 | -57 | 3 | 8 | 1 | 94 | 555.986 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.65 | -20.12 | 2 | 8 | 0 | 93 | 554.978 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.78 | 7.86 | -66.49 | 2 | 8 | 0 | 100 | 554.978 | 9 | ↓ |
