| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 21 | No |
| 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) | 3.46 | 11.22 | -9.1 | 1 | 3 | 0 | 38 | 320.483 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.92 | 10.1 | -39.13 | 0 | 3 | -1 | 41 | 319.475 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
