| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 33 | 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) | 4.60 | 12.86 | -15.34 | 1 | 7 | 0 | 98 | 440.455 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.06 | 11.8 | -49.15 | 0 | 7 | -1 | 101 | 439.447 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
