| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 12th, 2007 | 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) | 3.52 | 9.59 | -60.33 | 0 | 6 | -1 | 79 | 408.474 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 9.04 | -12.02 | 1 | 6 | 0 | 76 | 409.482 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.93 | 9.37 | -11.35 | 0 | 6 | 0 | 73 | 409.482 | 8 | ↓ |
