| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 30 | 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) | 0.39 | 8.52 | -113.66 | 3 | 7 | 0 | 102 | 425.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 8.28 | -67.74 | 2 | 7 | -1 | 101 | 424.399 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.39 | 6.5 | -67.34 | 4 | 7 | 1 | 99 | 426.415 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -2.36 | 6.59 | -88.47 | 4 | 7 | 1 | 105 | 426.415 | 4 | ↓ |
