| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 37 | 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) | 4.11 | 10.56 | -16.29 | 2 | 8 | 0 | 101 | 498.583 | 8 | ↓ |
| Ref Reference (pH 7) | 4.11 | 10.19 | -19.73 | 2 | 8 | 0 | 101 | 498.583 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.11 | 11.32 | -42.62 | 1 | 8 | -1 | 103 | 497.575 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 10.75 | -48.25 | 0 | 8 | -1 | 99 | 497.575 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 10.44 | -61.44 | 0 | 8 | -1 | 99 | 497.575 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.11 | 10.66 | -49.94 | 3 | 8 | 1 | 102 | 499.591 | 8 | ↓ |
