| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 29 | 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) | 4.26 | 11.19 | -15.63 | 2 | 7 | 0 | 85 | 455.005 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.30 | 10.73 | -52.59 | 1 | 7 | -1 | 86 | 453.997 | 7 | ↓ |
