Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D01RVF
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| Former ID |
DNC009748
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| Drug Name |
(R)-N-benzyl-4-(pyrrolidin-2-ylmethoxy)aniline
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| Synonyms |
N-Benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline; N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline; CHEMBL570775; SCHEMBL4314176; HITMFLNAOQIZSN-QGZVFWFLSA-N; BDBM50294163; DB07260
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1], [2] | |
| Structure |
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Download2D MOL |
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| Formula |
C18H22N2O
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| Canonical SMILES |
C1CC(NC1)COC2=CC=C(C=C2)NCC3=CC=CC=C3
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| InChI |
1S/C18H22N2O/c1-2-5-15(6-3-1)13-20-16-8-10-18(11-9-16)21-14-17-7-4-12-19-17/h1-3,5-6,8-11,17,19-20H,4,7,12-14H2/t17-/m1/s1
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| InChIKey |
HITMFLNAOQIZSN-QGZVFWFLSA-N
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Leukotriene A-4 hydrolase (LTA4H) | Target Info | Inhibitor | [1], [2] |
| BioCyc | Leukotriene biosynthesis | |||
| KEGG Pathway | Arachidonic acid metabolism | |||
| Metabolic pathways | ||||
| Pathwhiz Pathway | Arachidonic Acid Metabolism | |||
| WikiPathways | Arachidonic acid metabolism | |||
| Eicosanoid Synthesis | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. | |||
| REF 2 | Discovery of leukotriene A4 hydrolase inhibitors using metabolomics biased fragment crystallography. J Med Chem. 2009 Aug 13;52(15):4694-715. | |||
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