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Name | CHEMBL1202520 |
---|---|
Molecular formula | C26H31N5O2 |
IUPAC name | 12-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-12-azapentacyclo[4.4.3.12,5.17,10.01,6]pentadeca-3,8-diene-11,13-dione |
Molecular weight | 445.567 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 1.9 |
Synonyms | CHEMBL285141 BDBM50367725 |
Inchi Key | AGAOOOLNXNYSOT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H31N5O2/c32-22-25-18-4-5-19(16-18)26(25,21-7-6-20(25)17-21)23(33)31(22)11-2-1-10-29-12-14-30(15-13-29)24-27-8-3-9-28-24/h3-9,18-21H,1-2,10-17H2 |
PubChem CID | 14086530 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50367725 |
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 |
---|---|---|---|---|---|
4695 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
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