| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 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) | 3.50 | 5.94 | -16.46 | 2 | 9 | 0 | 115 | 486.937 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 5.97 | -46.89 | 1 | 9 | -1 | 118 | 485.929 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
