| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 17 | 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) | 1.72 | 6.65 | -42.72 | 1 | 4 | 0 | 48 | 242.363 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 4.37 | -42.82 | 0 | 4 | -1 | 47 | 241.355 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 6.64 | -60.36 | 1 | 4 | 0 | 48 | 242.363 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 8.92 | -107.16 | 2 | 4 | 1 | 49 | 243.371 | 6 | ↓ |
