| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2006 | 32 | 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) | 3.81 | 6.77 | -15.51 | 2 | 8 | 0 | 97 | 437.496 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.79 | 7.25 | -50.97 | 0 | 8 | -1 | 96 | 436.488 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.79 | 7.49 | -61.23 | 0 | 8 | -1 | 96 | 436.488 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.81 | 7.84 | -41.37 | 1 | 8 | -1 | 100 | 436.488 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 7.54 | -53.35 | 1 | 8 | -1 | 100 | 436.488 | 8 | ↓ |
