| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 5th, 2007 | 33 | 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) | 3.97 | 8.73 | -50 | 0 | 6 | -1 | 73 | 492.354 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | -0.11 | -51.69 | 1 | 6 | 1 | 68 | 494.37 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 11.06 | -68.41 | 1 | 6 | 0 | 74 | 493.362 | 7 | ↓ |
