| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | 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) | 3.16 | 6.92 | -53.16 | 3 | 3 | 1 | 46 | 272.368 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 7.87 | -64.67 | 2 | 3 | 0 | 49 | 271.36 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
