| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2009 | 9 | No |
Popular Name: 5-Amino-1H-imidazole-4-carboxamide hydrochloride 5-Amino-1H-imidazole-4-carboxami…
Find On: PubMed — Wikipedia — Google
CAS Number: 72-40-2
4-Amino-5-carboxamido imidazole HCl
4-Amino-5-carboxamidoimidazole hydrochloride
4-Formamido-5-aminoimidazole HCl
| 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) | -1.10 | 0.4 | -10.82 | 4 | 5 | 0 | 84 | 126.119 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.10 | -0.01 | -45.45 | 3 | 5 | -1 | 82 | 125.111 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -1.10 | 0.89 | -34.67 | 5 | 5 | 1 | 85 | 127.127 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0521463A2; EP0521463A3; US5631259 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.