| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2012 | 7 | Yes |
Popular Name: 1-Methyl-1H-imidazol-4-amine hydrochloride 1-Methyl-1H-imidazol-4-amine hyd…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 79578-98-6 , 89088-69-7 , [79578-98-6] , [89088-69-7]
| 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) | -0.40 | 2.66 | -7.24 | 2 | 3 | 0 | 44 | 97.121 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 3.16 | -28.84 | 3 | 3 | 1 | 45 | 98.129 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.40 | 2.39 | -38.16 | 3 | 3 | 1 | 45 | 98.129 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.