In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2005 | 9 | Yes |
Popular Name: 2-(1-Methyl-1H-imidazol-5-yl)ethanamine dihydrochloride 2-(1-Methyl-1H-imidazol-5-yl)eth…
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CAS Numbers: 36475-47-5 , 644-42-8
2-(1-methyl-1H-imidazol-5-yl)ethan-1-amine
2-(1-methyl-1H-imidazol-5-yl)ethan-1-amine dihydrochloride
2-(3-Methyl-3H-imidazol-4-yl)-ethylamine
3-METHYLHISTAMINE DIHYDROCHLORIDE
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) | -1.63 | 2.43 | -50.95 | 3 | 3 | 1 | 45 | 126.183 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 213 - 215 | Enamine Building Blocks |
MP | 213...215 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
HRH3-1-E | Histamine H3 Receptor (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1 | 1.40 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
HRH3_RAT | Q9QYN8 | Histamine H3 Receptor, Rat | 1 | 1.40 | Binding ≤ 1μM |
HRH3_RAT | Q9QYN8 | Histamine H3 Receptor, Rat | 1 | 1.40 | Binding ≤ 10μM |
Description | Species |
---|---|
G alpha (i) signalling events | |
Histamine receptors |
No pre-computed analogs available. Try a structural similarity search.