| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2012 | 10 | No |
Popular Name: 4-Imidazole acrylic acid dihydrate 4-Imidazole acrylic acid dihydrate
Find On: PubMed — Wikipedia — Google
CAS Number: 104-98-3
| 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) | -0.23 | 3.78 | -48.13 | 1 | 4 | -1 | 69 | 137.118 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.23 | 4.28 | -50.09 | 2 | 4 | 0 | 70 | 138.126 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.23 | 3.78 | -45.97 | 1 | 4 | -1 | 69 | 137.118 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0559893A1; EP0559893B1; EP0729472A1; EP0909798A1; EP0911374A1; EP0969840A1; US4443380; US4572803; US5300639; US5455036; US5494676; US5620680; US5658556; US5756735; US5932606; US6057362; US6100315; WO1995014025A1; WO1997008193A1; WO1998042342A1; WO200000 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.