| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 34 | 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) | 3.93 | 0.83 | -51.42 | 2 | 7 | 1 | 79 | 482.004 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 0.98 | -61.37 | 1 | 7 | 1 | 76 | 482.004 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 1 | -94.92 | 3 | 7 | 2 | 80 | 483.012 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 1.14 | -109.5 | 2 | 7 | 2 | 77 | 483.012 | 9 | ↓ |
