| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 19 | 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) | 1.00 | 4.73 | -47.19 | 2 | 4 | 1 | 42 | 258.345 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 3.37 | -10.49 | 1 | 4 | 0 | 37 | 257.337 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
