| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 5th, 2007 | 37 | 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) | 5.48 | 12.86 | -59.51 | 0 | 7 | -1 | 92 | 511.579 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.90 | 13.08 | -12.91 | 0 | 7 | 0 | 86 | 512.587 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.93 | 12.79 | -19.67 | 1 | 7 | 0 | 89 | 512.587 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 5.12 | -10.91 | 0 | 7 | 0 | 68 | 338.433 | 2 | ↓ |
