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Name | CHEMBL76763 |
---|---|
Molecular formula | C37H40N4O5 |
IUPAC name | 2-methyl-N-[4-[methyl-[2-[2-(4-piperidin-1-ylpiperidine-1-carbonyl)phenoxy]phenyl]carbamoyl]phenyl]furan-3-carboxamide |
Molecular weight | 620.75 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 5.7 |
Synonyms | BDBM50108503 2-Methyl-furan-3-carboxylic acid [4-({2-[2-([1,4'']bipiperidinyl-1''-carbonyl)-phenoxy]-phenyl}-methyl-carbamoyl)-phenyl]-amide |
Inchi Key | BLVDTYXRFJFTEH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C37H40N4O5/c1-26-30(20-25-45-26)35(42)38-28-16-14-27(15-17-28)36(43)39(2)32-11-5-7-13-34(32)46-33-12-6-4-10-31(33)37(44)41-23-18-29(19-24-41)40-21-8-3-9-22-40/h4-7,10-17,20,25,29H,3,8-9,18-19,21-24H2,1-2H3,(H,38,42) |
PubChem CID | 44314536 |
ChEMBL | CHEMBL76763 |
IUPHAR | N/A |
BindingDB | 50108503 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
27013 | Vasopressin V1a receptor | P30560 | Avpr1a | Rattus norvegicus (Rat) | 424 |
27012 | Vasopressin V2 receptor | Q00788 | Avpr2 | Rattus norvegicus (Rat) | 371 |
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