| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 33 | 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) | 3.44 | 12.17 | -50.23 | 2 | 8 | 1 | 92 | 470.619 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 10.02 | -16.92 | 1 | 8 | 0 | 91 | 469.611 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
