| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2009 | 31 | 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) | 3.16 | 4.83 | -15.36 | 3 | 8 | 0 | 115 | 438.871 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 4.04 | -12.52 | 3 | 8 | 0 | 115 | 438.871 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 4.46 | -52.42 | 4 | 8 | 1 | 117 | 439.879 | 5 | ↓ |
