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Name | CHEMBL3670932 |
---|---|
Molecular formula | C25H32N4O |
IUPAC name | 4-[(E)-3-[4-[(2-ethyl-5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]phenyl]prop-2-enyl]piperidin-4-ol |
Molecular weight | 404.558 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | SCHEMBL12802589 4-{(E)-3-[4-(2-Ethyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-3-ylmethyl)-phenyl]-allyl}-piperidin-4-ol SCHEMBL12802593 BDBM123478 US8748435, 3 [ Show all ] |
Inchi Key | CBCJTISJWHFCOC-AATRIKPKSA-N |
Inchi ID | InChI=1S/C25H32N4O/c1-4-23-22(24-27-18(2)16-19(3)29(24)28-23)17-21-9-7-20(8-10-21)6-5-11-25(30)12-14-26-15-13-25/h5-10,16,26,30H,4,11-15,17H2,1-3H3/b6-5+ |
PubChem CID | 68379125 |
ChEMBL | CHEMBL3670932 |
IUPHAR | N/A |
BindingDB | 123478 |
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 |
---|---|---|---|---|---|
37728 | G-protein coupled receptor 4 | P46093 | GPR4 | Homo sapiens (Human) | 362 |
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