| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 15th, 2009 | 25 | 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) | 1.06 | 5.68 | -33.26 | 2 | 6 | 1 | 57 | 353.531 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.06 | 3.54 | -11.19 | 1 | 6 | 0 | 56 | 352.523 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 5.69 | -40.06 | 2 | 6 | 1 | 57 | 353.531 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.06 | 8.05 | -108.46 | 3 | 6 | 2 | 58 | 354.539 | 7 | ↓ |
