| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 20th, 2006 | 27 | 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) | 2.81 | 4.56 | -12.91 | 3 | 8 | 0 | 134 | 359.345 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 5.64 | -13.27 | 3 | 8 | 0 | 134 | 359.345 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 5.44 | -59.83 | 4 | 8 | 1 | 135 | 360.353 | 3 | ↓ |
