| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 20 | 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) | 3.11 | 6.82 | -8.9 | 1 | 5 | 0 | 75 | 271.272 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 7.75 | -42.75 | 0 | 5 | -1 | 78 | 270.264 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
