| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2011 | 9 | Yes |
Popular Name: 2-(1H-Imidazol-2-yl)acetic acid 2-(1H-Imidazol-2-yl)acetic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1297344-60-5 , 189502-92-9 , 189502-92-9; . , [189502-92-9] , [18955-88-9] , [3251-69-2]
2-(1H-Imidazol-2-yl)acetic acid hydrochloride
2-(1H-Imidazol-2-yl)aceticacid
2-(3-Methoxyphenyl)malondialdehyde
| 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) | -0.54 | 2.83 | -36.94 | 2 | 4 | 0 | 70 | 126.115 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.54 | 2.55 | -50.67 | 1 | 4 | -1 | 69 | 125.107 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5574016 | IBM Patent Data |
| PUBCHEM_PATENT_ID | US6080743; WO1997008155A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.