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Name | CHEMBL143947 |
---|---|
Molecular formula | C27H34N6O |
IUPAC name | (1R,2R)-1-phenyl-1-[[1-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperidin-4-yl]amino]propan-2-ol |
Molecular weight | 458.61 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 3.3 |
Synonyms | (1R,2R)-1-Phenyl-1-{1-[3-(5-[1,2,4]triazol-4-yl-1H-indol-3-yl)-propyl]-piperidin-4-ylamino}-propan-2-ol BDBM50083082 SCHEMBL4578339 (1R,2R)-1-[[1-[3-[5-(4H-1,2,4-Triazole-4-yl)-1H-indole-3-yl]propyl]piperidine-4-yl]amino]-1-phenyl-2-propanol |
Inchi Key | AMZZHMUOOCFWEG-HRFSGMKKSA-N |
Inchi ID | InChI=1S/C27H34N6O/c1-20(34)27(21-6-3-2-4-7-21)31-23-11-14-32(15-12-23)13-5-8-22-17-28-26-10-9-24(16-25(22)26)33-18-29-30-19-33/h2-4,6-7,9-10,16-20,23,27-28,31,34H,5,8,11-15H2,1H3/t20-,27+/m1/s1 |
PubChem CID | 10527882 |
ChEMBL | CHEMBL143947 |
IUPHAR | N/A |
BindingDB | 50083082 |
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 |
---|---|---|---|---|---|
9389 | 5-hydroxytryptamine receptor 1B | P28222 | HTR1B | Homo sapiens (Human) | 390 |
9388 | 5-hydroxytryptamine receptor 1D | P28221 | HTR1D | Homo sapiens (Human) | 377 |
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