| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2008 | 26 | No |
None
| 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) | 2.30 | 7.22 | -28.33 | 1 | 6 | 0 | 74 | 354.406 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 4.82 | -46.58 | 0 | 6 | -1 | 73 | 353.398 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 7.34 | -55.43 | 1 | 6 | 0 | 74 | 354.406 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 6.66 | -45.25 | 2 | 6 | 1 | 71 | 355.414 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 4.21 | -10.32 | 1 | 6 | 0 | 70 | 354.406 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.30 | 6.6 | -49.34 | 2 | 6 | 1 | 71 | 355.414 | 3 | ↓ |
