| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2011 | 14 | 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) | -0.54 | -0.86 | -57.83 | 2 | 6 | 0 | 73 | 196.258 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.54 | -2.21 | -38.73 | 1 | 6 | -1 | 68 | 195.25 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.54 | -0.87 | -41.02 | 3 | 6 | 1 | 74 | 197.266 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.