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Name | MLS000556376 |
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Molecular formula | C19H15BrN4 |
IUPAC name | 8-bromo-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5H-pyrimido[5,4-b]indole |
Molecular weight | 379.261 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 4.4 |
Synonyms | 799785-21-0 STK552210 8-bromo-4-(3,4-dihydro-1H-isoquinolin-2-yl)-5H-pyrimid[5,4-b]indole HMS2364L19 AKOS005479410 [ Show all ] |
Inchi Key | AHJWDZVAOCDVBU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H15BrN4/c20-14-5-6-16-15(9-14)17-18(23-16)19(22-11-21-17)24-8-7-12-3-1-2-4-13(12)10-24/h1-6,9,11,23H,7-8,10H2 |
PubChem CID | 3773351 |
ChEMBL | CHEMBL1377902 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
5635 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
463560 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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