| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 21 | 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) | 2.42 | 3.42 | -98.03 | 0 | 6 | -2 | 101 | 345.163 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 3.35 | -50.92 | 1 | 6 | -1 | 99 | 346.171 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 3.86 | -81.78 | 1 | 6 | -1 | 103 | 346.171 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.