| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 21 | No |
Popular Name: (E)-3-[5-fluoro-2-[(4-hydroxypyrimidin-2-yl)sulfanylmethyl]phenyl]prop-2-enoic (E)-3-[5-fluoro-2-[(4-hydroxypyr…
| 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) | 2.41 | 7.38 | -53.44 | 1 | 5 | -1 | 86 | 305.31 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | 5.4 | -109.72 | 0 | 5 | -2 | 89 | 304.302 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.41 | 7.81 | -67.17 | 2 | 5 | 0 | 87 | 306.318 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
