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Name | CHEMBL406676 |
---|---|
Molecular formula | C24H28F3N5O |
IUPAC name | N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-2-yl]-2-(trifluoromethyl)quinazolin-4-amine |
Molecular weight | 459.517 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | BDBM50373823 |
Inchi Key | HQSTUFQPVLSVBX-KRWDZBQOSA-N |
Inchi ID | InChI=1S/C24H28F3N5O/c1-3-17(16-31-12-14-32(15-13-31)20-10-6-7-11-21(20)33-2)28-22-18-8-4-5-9-19(18)29-23(30-22)24(25,26)27/h4-11,17H,3,12-16H2,1-2H3,(H,28,29,30)/t17-/m0/s1 |
PubChem CID | 44454245 |
ChEMBL | CHEMBL406676 |
IUPHAR | N/A |
BindingDB | 50373823 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
121712 | Lysophosphatidic acid receptor 2 | Q9HBW0 | LPAR2 | Homo sapiens (Human) | 351 |
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