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Name | CHEMBL1186825 |
---|---|
Molecular formula | C30H29ClF2N4O2 |
IUPAC name | (2Z)-2-[1-[2-chloro-4-(3-methylpyrrolidin-1-yl)benzoyl]-4,4-difluoro-2,3-dihydro-1-benzazepin-5-ylidene]-N-(pyridin-2-ylmethyl)acetamide |
Molecular weight | 551.035 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 5.0 |
Synonyms | 5H-1-benzazepin-5-ylidene acetamide, 10j BDBM35703 |
Inchi Key | CTJJSXBYCXHYPK-UQQQWYQISA-N |
Inchi ID | InChI=1S/C30H29ClF2N4O2/c1-20-11-14-36(19-20)22-9-10-24(26(31)16-22)29(39)37-15-12-30(32,33)25(23-7-2-3-8-27(23)37)17-28(38)35-18-21-6-4-5-13-34-21/h2-10,13,16-17,20H,11-12,14-15,18-19H2,1H3,(H,35,38)/b25-17- |
PubChem CID | 44520880 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 35703 |
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 |
---|---|---|---|---|---|
50150 | Vasopressin V2 receptor | P30518 | AVPR2 | Homo sapiens (Human) | 371 |
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