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Name | CHEMBL166265 |
---|---|
Molecular formula | C26H22FN3O2 |
IUPAC name | N-[4-(3,9-diazatricyclo[6.4.1.04,13]trideca-1,4(13),5,7-tetraene-9-carbonyl)phenyl]-5-fluoro-2-methylbenzamide |
Molecular weight | 427.479 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 4.8 |
Synonyms | BDBM50125110 N-[4-(3,4,5,6-Tetrahydro-1H-azepino[4,3,2-cd]indole-6-ylcarbonyl)phenyl]-2-methyl-5-fluorobenzamide 5-Fluoro-2-methyl-N-[4-(1,3,4,5-tetrahydro-azepino[4,3,2-cd]indole-6-carbonyl)-phenyl]-benzamide |
Inchi Key | CCJORWLGDANJOB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H22FN3O2/c1-16-7-10-19(27)14-21(16)25(31)29-20-11-8-17(9-12-20)26(32)30-13-3-4-18-15-28-22-5-2-6-23(30)24(18)22/h2,5-12,14-15,28H,3-4,13H2,1H3,(H,29,31) |
PubChem CID | 44377837 |
ChEMBL | CHEMBL166265 |
IUPHAR | N/A |
BindingDB | 50125110 |
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 |
---|---|---|---|---|---|
38655 | Vasopressin V2 receptor | P30518 | AVPR2 | Homo sapiens (Human) | 371 |
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