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Name | CHEMBL15965 |
---|---|
Molecular formula | C28H37FN6O2 |
IUPAC name | 1-[2-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]ethyl]-3-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]urea |
Molecular weight | 508.642 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 3.3 |
Synonyms | 1-[3-(4-Methylpiperazino)-4-methoxyphenyl]-3-[2-[4-(6-fluoro-1H-indole-3-yl)piperidino]ethyl]urea BDBM50086114 SCHEMBL6346305 1-{2-[4-(6-Fluoro-1H-indol-3-yl)-piperidin-1-yl]-ethyl}-3-[4-methoxy-3-(4-methyl-piperazin-1-yl)-phenyl]-urea |
Inchi Key | FBHJLENKHMRXEZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H37FN6O2/c1-33-13-15-35(16-14-33)26-18-22(4-6-27(26)37-2)32-28(36)30-9-12-34-10-7-20(8-11-34)24-19-31-25-17-21(29)3-5-23(24)25/h3-6,17-20,31H,7-16H2,1-2H3,(H2,30,32,36) |
PubChem CID | 10696986 |
ChEMBL | CHEMBL15965 |
IUPHAR | N/A |
BindingDB | 50086114 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
74193 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
74192 | 5-hydroxytryptamine receptor 1B | P28564 | Htr1b | Rattus norvegicus (Rat) | 386 |
74194 | 5-hydroxytryptamine receptor 1D | P28565 | Htr1d | Rattus norvegicus (Rat) | 374 |
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