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Name | CHEMBL27701 |
---|---|
Molecular formula | C33H26Cl2F3N3O3 |
IUPAC name | N-[2,4-dichloro-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]-N-methyl-2-[1-methyl-5-[4-(trifluoromethyl)benzoyl]pyrrol-2-yl]acetamide |
Molecular weight | 640.484 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 0 |
XlogP | 7.6 |
Synonyms | BDBM50126257 N-[2,4-Dichloro-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-N-methyl-2-[1-methyl-5-(4-trifluoromethyl-benzoyl)-1H-pyrrol-2-yl]-acetamide |
Inchi Key | CUYIJPZNNGZEQQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H26Cl2F3N3O3/c1-19-7-8-20-5-4-6-28(31(20)39-19)44-18-24-25(34)14-16-26(30(24)35)41(3)29(42)17-23-13-15-27(40(23)2)32(43)21-9-11-22(12-10-21)33(36,37)38/h4-16H,17-18H2,1-3H3 |
PubChem CID | 44276666 |
ChEMBL | CHEMBL27701 |
IUPHAR | N/A |
BindingDB | 50126257 |
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 |
---|---|---|---|---|---|
51258 | B2 bradykinin receptor | P30411 | BDKRB2 | Homo sapiens (Human) | 391 |
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