| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 14 | No |
| 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) | 1.33 | 5.59 | -87.98 | 3 | 3 | 2 | 30 | 215.366 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 3.25 | -26.46 | 2 | 3 | 1 | 29 | 214.358 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 3.37 | -27.28 | 2 | 3 | 1 | 29 | 214.358 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
