| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 29 | 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) | 0.72 | 1.36 | -66.09 | 5 | 8 | 1 | 113 | 411.519 | 13 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | -0.08 | -29.91 | 4 | 8 | 0 | 109 | 410.511 | 13 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 0.8 | -90.83 | 6 | 8 | 2 | 111 | 412.527 | 13 | ↓ |
