| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 12 | 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) | 2.07 | 5.87 | -40.13 | 2 | 1 | 1 | 17 | 180.296 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 4.18 | -2.77 | 1 | 1 | 0 | 12 | 179.288 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
