Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0TU7I
|
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| Former ID |
DNC009429
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| Drug Name |
(E)-8-(3-chlorostyryl)-caffeine
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent | Investigative | [530425] | ||
| Structure |
|
Download2D MOL |
|||
| Formula |
C16H15ClN4O2
|
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| Canonical SMILES |
CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)C=CC3=CC(=CC=C3)Cl
|
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| InChI |
1S/C16H15ClN4O2/c1-19-12(8-7-10-5-4-6-11(17)9-10)18-14-13(19)15(22)21(3)16(23)20(14)2/h4-9H,1-3H3/b8-7+
|
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| InChIKey |
WBWFIUAVMCNYPG-BQYQJAHWSA-N
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| PubChem Compound ID | |||||
| Target and Pathway | |||||
| Target(s) | Amine oxidase [flavin-containing] B | Target Info | Inhibitor | [530425] | |
| KEGG Pathway | Glycine, serine and threonine metabolism | ||||
| Arginine and proline metabolism | |||||
| Histidine metabolism | |||||
| Tyrosine metabolism | |||||
| Phenylalanine metabolism | |||||
| Tryptophan metabolism | |||||
| Drug metabolism - cytochrome P450 | |||||
| Metabolic pathways | |||||
| Serotonergic synapse | |||||
| Dopaminergic synapse | |||||
| Cocaine addiction | |||||
| Amphetamine addiction | |||||
| Alcoholism | |||||
| Pathway Interaction Database | Alpha-synuclein signaling | ||||
| References | |||||
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