| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 5th, 2005 | 13 | Yes |
Popular Name: 3-Chloro-6-piperazinopyridazine 3-Chloro-6-piperazinopyridazine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 100241-11-0 , 1177360-01-8 , 56392-83-7
3-Chloro-6-(piperazin-1-yl)pyridazine
3-chloro-6-(piperazin-1-yl)pyridazine hydrochloride
3-chloro-6-piperazin-1-ylpyridazine
3-chloro-6-piperazin-1-ylpyridazine dihydrochloride
3-Chloro-6-piperazinopyridazine Hydrochloride
3-Chloro-6-piperazinopyridazine, 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) | 0.95 | 3.21 | -49.5 | 2 | 4 | 1 | 46 | 199.665 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 1.91 | -7.65 | 1 | 4 | 0 | 41 | 198.657 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 103 - 105 | Enamine Building Blocks |
| MP | 103...105 | Enamine Building Blocks |
| MP | 294 - 296 | Enamine Building Blocks |
| MP | 294...296 | 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 |
|---|---|---|---|---|---|
| ACHA7-1-E | Neuronal Acetylcholine Receptor Protein Alpha-7 Subunit (cluster #1 Of 6), Eukaryotic | Eukaryotes | 32 | 0.81 | Binding ≤ 10μM |
| ACHB4-6-E | Neuronal Acetylcholine Receptor Subunit Beta-4 (cluster #6 Of 7), Eukaryotic | Eukaryotes | 32 | 0.81 | Binding ≤ 10μM |
| Z104290-1-O | Neuronal Acetylcholine Receptor; Alpha4/beta2 (cluster #1 Of 4), Other | Other | 1030 | 0.64 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACHA7_RAT | Q05941 | Neuronal Acetylcholine Receptor Protein Alpha-7 Subunit, Rat | 32 | 0.81 | Binding ≤ 1μM |
| ACHB4_RAT | P12392 | Neuronal Acetylcholine Receptor Protein Beta-4 Subunit, Rat | 32 | 0.81 | Binding ≤ 1μM |
| ACHA7_RAT | Q05941 | Neuronal Acetylcholine Receptor Protein Alpha-7 Subunit, Rat | 32 | 0.81 | Binding ≤ 10μM |
| ACHB4_RAT | P12392 | Neuronal Acetylcholine Receptor Protein Beta-4 Subunit, Rat | 32 | 0.81 | Binding ≤ 10μM |
| Z104290 | Z104290 | Neuronal Acetylcholine Receptor; Alpha4/beta2 | 1030 | 0.64 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Highly calcium permeable nicotinic acetylcholine receptors | |
| Highly sodium permeable acetylcholine nicotinic receptors |
