| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 16 | 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) | 1.37 | 4.82 | -57.32 | 3 | 5 | 1 | 77 | 222.268 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 4.53 | -6.69 | 2 | 5 | 0 | 75 | 221.26 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
