| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 33 | 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) | 2.97 | 11.67 | -31.26 | 1 | 8 | 0 | 91 | 455.547 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 10.61 | -53.79 | 0 | 8 | -1 | 97 | 454.539 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.97 | 12.12 | -45.66 | 2 | 8 | 1 | 92 | 456.555 | 6 | ↓ |
