| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 14 | 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) | 0.66 | 3.07 | -48.15 | 3 | 3 | 1 | 54 | 189.238 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.66 | 2.73 | -6.49 | 2 | 3 | 0 | 52 | 188.23 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.66 | 3.5 | -108.97 | 4 | 3 | 2 | 55 | 190.246 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
