| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 34 | 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) | 3.07 | 8.19 | -59.67 | 1 | 8 | -1 | 112 | 460.462 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 6.21 | -29.7 | 2 | 8 | 0 | 109 | 461.47 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 7.19 | -24.61 | 1 | 8 | 0 | 106 | 461.47 | 9 | ↓ |
