| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 15 | 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) | 0.86 | 3.3 | -8.65 | 4 | 5 | 0 | 84 | 202.217 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 2.71 | -34.67 | 3 | 5 | -1 | 86 | 201.209 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.86 | 3.77 | -39 | 5 | 5 | 1 | 85 | 203.225 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
