| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2011 | 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) | 0.28 | 2.84 | -54.58 | 3 | 9 | 1 | 109 | 386.432 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.74 | -1.23 | -55.8 | 1 | 9 | -1 | 111 | 384.416 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 0.49 | -17.81 | 2 | 9 | 0 | 108 | 385.424 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 1.12 | -81.87 | 2 | 9 | 0 | 112 | 385.424 | 5 | ↓ |
