| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2005 | 30 | 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) | 4.67 | 9.94 | -24 | 1 | 5 | 0 | 72 | 410.558 | 8 | ↓ |
| Mid Mid (pH 6-8) | 5.25 | 0.95 | -35.19 | 3 | 5 | 1 | 76 | 411.566 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.67 | 0.31 | -38.66 | 2 | 5 | 1 | 73 | 411.566 | 8 | ↓ |
