| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 27 | 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) | 3.44 | 3.18 | -13.69 | 2 | 7 | 0 | 101 | 440.856 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 2.01 | -42.18 | 1 | 7 | -1 | 107 | 439.848 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
