| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 28 | 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) | 2.66 | 7.36 | -69.78 | 0 | 6 | -1 | 79 | 398.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 6.93 | -14.01 | 0 | 6 | 0 | 73 | 399.468 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 6.5 | -16.01 | 1 | 6 | 0 | 76 | 399.468 | 6 | ↓ |
