| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 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) | 4.15 | 11.48 | -58.3 | 0 | 7 | -1 | 96 | 431.468 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 11.83 | -11.18 | 0 | 7 | 0 | 90 | 432.476 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | 11.11 | -11.75 | 1 | 7 | 0 | 93 | 432.476 | 5 | ↓ |
