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Name | CHEMBL262384 |
---|---|
Molecular formula | C29H29N5O7 |
IUPAC name | 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[[5-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]-1-benzofuran-2-yl]methyl]acetamide |
Molecular weight | 559.579 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 1.6 |
Synonyms | 1-[1-[2-[[(2,5-Dioxo-3-methyl-1-imidazolidinylacetyl)amino]methyl]-5-benzofuranylcarbonyl]-4-piperidinyl]-1,4-dihydro-2H-3,1-benzoxazine-2-one BDBM50219727 |
Inchi Key | AJOOQKDCBQLRIU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H29N5O7/c1-31-16-26(36)33(28(31)38)15-25(35)30-14-22-13-20-12-18(6-7-24(20)41-22)27(37)32-10-8-21(9-11-32)34-23-5-3-2-4-19(23)17-40-29(34)39/h2-7,12-13,21H,8-11,14-17H2,1H3,(H,30,35) |
PubChem CID | 44279410 |
ChEMBL | CHEMBL262384 |
IUPHAR | N/A |
BindingDB | 50219727 |
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 |
---|---|---|---|---|---|
7090 | Oxytocin receptor | P30559 | OXTR | Homo sapiens (Human) | 389 |
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