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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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A607474-5mg
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5mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
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$1,334.90
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A607474-25mg
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25mg |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
|
$2,001.90
|
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| Synonyms | AKN028 | AKN-028 | Y66IS3CS0R | AKOS040756521 | 2,3-Pyrazinediamine, N3-1H-indol-5-yl-5-(4-pyridinyl)- | 1175017-90-9 | UNII-Y66IS3CS0R | DB12746 | N2-(1H-Indol-5-yl)-6-(pyridin-4-yl)pyrazine-2,3-diamine | 3-N-(1H-indol-5-yl)-5-pyridin-4-ylpyrazine-2,3-di |
|---|---|
| Specifications & Purity | Moligand™ |
| Grade | Moligand™ |
| Action Type | INHIBITOR |
| Mechanism of action | Inhibitor of fms related receptor tyrosine kinase 3;Inhibitor of KIT proto-oncogene; receptor tyrosine kinase |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Indoles and derivatives |
| Subclass | Indoles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indoles |
| Alternative Parents | Aminopyrazines Pyridines and derivatives Imidolactams Benzenoids Pyrroles Heteroaromatic compounds Secondary amines Azacyclic compounds Primary amines Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Indole - Aminopyrazine - Pyrazine - Imidolactam - Benzenoid - Pyridine - Heteroaromatic compound - Pyrrole - Azacycle - Secondary amine - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole. |
| External Descriptors | Not available |
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| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| IUPAC Name | 3-N-(1H-indol-5-yl)-5-pyridin-4-ylpyrazine-2,3-diamine |
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| INCHI | InChI=1S/C17H14N6/c18-16-17(22-13-1-2-14-12(9-13)5-8-20-14)23-15(10-21-16)11-3-6-19-7-4-11/h1-10,20H,(H2,18,21)(H,22,23) |
| InChIKey | JLRIJKVMMZEKDF-UHFFFAOYSA-N |
| Smiles | Nc1ncc(nc1Nc1ccc2c(c1)cc[nH]2)c1ccncc1 |
| Isomeric SMILES | C1=CC2=C(C=CN2)C=C1NC3=NC(=CN=C3N)C4=CC=NC=C4 |
| PubChem CID | 44177328 |
| Molecular Weight | 302.330 g/mol |
|---|---|
| XLogP3 | 2.000 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 302.128 Da |
| Monoisotopic Mass | 302.128 Da |
| Topological Polar Surface Area | 92.500 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 385.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |