| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 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) | 3.84 | 9.83 | -60.55 | 0 | 7 | -1 | 92 | 446.479 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.26 | 1.54 | -14.49 | 0 | 7 | 0 | 86 | 447.487 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.84 | 9.01 | -15.82 | 1 | 7 | 0 | 89 | 447.487 | 9 | ↓ |
