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Name | CHEMBL496787 |
---|---|
Molecular formula | C26H32ClN5O4 |
IUPAC name | [4-[1-[4-(4-chloroanilino)-6,7-dimethoxyquinazolin-2-yl]piperidin-4-yl]morpholin-2-yl]methanol |
Molecular weight | 514.023 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | BDBM50265733 [4-(1-{4-[(4-Chlorophenyl)amino]-6,7-dimethoxyquinazolin-2-yl}piperidin-4-yl)morpholin-2-yl]methanol |
Inchi Key | JHZGCUVRJZBRDR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H32ClN5O4/c1-34-23-13-21-22(14-24(23)35-2)29-26(30-25(21)28-18-5-3-17(27)4-6-18)31-9-7-19(8-10-31)32-11-12-36-20(15-32)16-33/h3-6,13-14,19-20,33H,7-12,15-16H2,1-2H3,(H,28,29,30) |
PubChem CID | 44581068 |
ChEMBL | CHEMBL496787 |
IUPHAR | N/A |
BindingDB | 50265733 |
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 |
---|---|---|---|---|---|
151425 | C-C chemokine receptor type 4 | P51679 | CCR4 | Homo sapiens (Human) | 360 |
151426 | C-C chemokine receptor type 4 | P51680 | Ccr4 | Mus musculus (Mouse) | 360 |
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