| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2011 | 23 | 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) | -5.09 | -17.42 | -101.97 | 12 | 11 | 2 | 204 | 342.345 | 4 | ↓ |
| Hi High (pH 8-9.5) | -5.09 | -18.14 | -13.31 | 10 | 11 | 0 | 201 | 340.329 | 4 | ↓ |
| Mid Mid (pH 6-8) | -5.09 | -17.81 | -48.8 | 11 | 11 | 1 | 203 | 341.337 | 4 | ↓ |
| Mid Mid (pH 6-8) | -5.09 | -17.76 | -51.5 | 11 | 11 | 1 | 203 | 341.337 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.