| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2007 | 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) | 5.06 | 13.6 | -62.81 | 0 | 6 | -1 | 83 | 483.588 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.47 | 1.39 | -22.46 | 0 | 6 | 0 | 76 | 484.596 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 5.06 | 1.64 | -44.18 | 2 | 6 | 1 | 80 | 485.604 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.47 | 1.5 | -53.81 | 1 | 6 | 1 | 77 | 485.604 | 8 | ↓ |
