| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2009 | 33 | 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) | -0.04 | 5.16 | -15.5 | 2 | 10 | 0 | 125 | 449.467 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.04 | 4.71 | -48.52 | 1 | 10 | -1 | 123 | 448.459 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.04 | 5.64 | -45.27 | 3 | 10 | 1 | 126 | 450.475 | 5 | ↓ |
