| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 30 | Yes |
| 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) | 3.64 | 3.89 | -22.91 | 2 | 8 | 0 | 111 | 456.586 | 13 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 4.05 | -93.37 | 0 | 8 | -2 | 115 | 454.57 | 13 | ↓ |
| Mid Mid (pH 6-8) | 3.64 | 3.98 | -52.06 | 1 | 8 | -1 | 113 | 455.578 | 13 | ↓ |
