| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2008 | 28 | 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) | 4.04 | 8.01 | -21.73 | 2 | 7 | 0 | 101 | 435.6 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | 8.27 | -19.72 | 2 | 7 | 0 | 101 | 435.6 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 6.64 | -54.06 | 1 | 7 | -1 | 104 | 434.592 | 5 | ↓ |
