| 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) | 2.70 | 9.04 | -70.42 | 1 | 8 | 0 | 93 | 466.534 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 6.76 | -59.52 | 0 | 8 | -1 | 91 | 465.526 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 7.91 | -55.02 | 2 | 8 | 1 | 90 | 467.542 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 8.89 | -57.78 | 1 | 8 | 1 | 87 | 467.542 | 9 | ↓ |
