| 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) | 0.73 | 8.89 | -108.23 | 3 | 7 | 0 | 102 | 419.428 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.73 | 8.68 | -67.4 | 2 | 7 | -1 | 101 | 418.42 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 6.87 | -62.47 | 4 | 7 | 1 | 99 | 420.436 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -2.01 | 6.96 | -83.41 | 4 | 7 | 1 | 105 | 420.436 | 4 | ↓ |
