| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 32 | 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) | 3.28 | 10.61 | -62.07 | 0 | 6 | -1 | 79 | 426.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.70 | 9.83 | -23.98 | 0 | 6 | 0 | 73 | 427.456 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 8.84 | -28.48 | 1 | 6 | 0 | 76 | 427.456 | 4 | ↓ |
