| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2011 | 35 | 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) | 5.56 | 17.32 | -69.82 | 1 | 6 | 0 | 66 | 472.633 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.56 | 15.11 | -53.92 | 0 | 6 | -1 | 64 | 471.625 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.56 | 17.81 | -134.59 | 2 | 6 | 1 | 67 | 473.641 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
