| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 8 | 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) | -0.31 | 0.27 | -43.71 | 3 | 2 | 1 | 37 | 114.168 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | -0.14 | -2.61 | 2 | 2 | 0 | 35 | 113.16 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
