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Name | CHEMBL488690 |
---|---|
Molecular formula | C27H37ClN6O2 |
IUPAC name | N-(4-chlorophenyl)-2-[4-[2-(diethylamino)ethyl]-1,4-diazepan-1-yl]-6,7-dimethoxyquinazolin-4-amine |
Molecular weight | 513.083 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 5.4 |
Synonyms | BDBM50245112 N-(4-Chlorophenyl)-2-{4-[2-(diethylamino)ethyl]-1,4-diazepan-1-yl}-6,7-dimethoxyquinazolin-4-amine |
Inchi Key | ABSJDAAPHZEZFF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H37ClN6O2/c1-5-32(6-2)14-15-33-12-7-13-34(17-16-33)27-30-23-19-25(36-4)24(35-3)18-22(23)26(31-27)29-21-10-8-20(28)9-11-21/h8-11,18-19H,5-7,12-17H2,1-4H3,(H,29,30,31) |
PubChem CID | 44562236 |
ChEMBL | CHEMBL488690 |
IUPHAR | N/A |
BindingDB | 50245112 |
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 |
---|---|---|---|---|---|
1131 | C-C chemokine receptor type 4 | P51679 | CCR4 | Homo sapiens (Human) | 360 |
1132 | C-C chemokine receptor type 4 | P51680 | Ccr4 | Mus musculus (Mouse) | 360 |
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