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Name | CHEMBL105118 |
---|---|
Molecular formula | C20H21N5O3 |
IUPAC name | N-[3-(1-methylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-nitrobenzamide |
Molecular weight | 379.42 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 2.6 |
Synonyms | SCHEMBL7006913 BDBM50130453 HQXYOWRNDBMCID-UHFFFAOYSA-N 5-(N-[3-nitrobenzoyl]amino)-3-(1-methylpiperidin-4-yl)pyrrolo[3,2-b]pyridine N-[3-(1-Methyl-piperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-nitro-benzamide |
Inchi Key | HQXYOWRNDBMCID-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H21N5O3/c1-24-9-7-13(8-10-24)16-12-21-17-5-6-18(22-19(16)17)23-20(26)14-3-2-4-15(11-14)25(27)28/h2-6,11-13,21H,7-10H2,1H3,(H,22,23,26) |
PubChem CID | 11047115 |
ChEMBL | CHEMBL105118 |
IUPHAR | N/A |
BindingDB | 50130453 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
121835 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
121838 | 5-hydroxytryptamine receptor 1B | P28222 | HTR1B | Homo sapiens (Human) | 390 |
121836 | 5-hydroxytryptamine receptor 1D | P28221 | HTR1D | Homo sapiens (Human) | 377 |
121837 | 5-hydroxytryptamine receptor 1F | P30939 | HTR1F | Homo sapiens (Human) | 366 |
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