| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 18 | Yes |
None
| 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) | 1.30 | 3.54 | -44.81 | 1 | 5 | 0 | 86 | 259.29 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 3.09 | -44.15 | 0 | 5 | -1 | 85 | 258.282 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 2.94 | -12.29 | 1 | 5 | 0 | 83 | 259.29 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
