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Name | CHEMBL286520 |
---|---|
Molecular formula | C36H32Cl2N4O3 |
IUPAC name | 2-[1-butyl-5-(4-cyanobenzoyl)pyrrol-2-yl]-N-[2,4-dichloro-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]-N-methylacetamide |
Molecular weight | 639.577 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 7.6 |
Synonyms | BDBM50126263 N-[2,4-Dichloro-3-(2-methyl-8-quinolinyloxymethyl)phenyl]-N-methyl-1-butyl-5-(4-cyanobenzoyl)-1H-pyrrole-2-acetamide 2-[1-Butyl-5-(4-cyano-benzoyl)-1H-pyrrol-2-yl]-N-[2,4-dichloro-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-N-methyl-acetamide |
Inchi Key | CHVIKJMAMMBGPY-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C36H32Cl2N4O3/c1-4-5-19-42-27(15-17-31(42)36(44)26-13-10-24(21-39)11-14-26)20-33(43)41(3)30-18-16-29(37)28(34(30)38)22-45-32-8-6-7-25-12-9-23(2)40-35(25)32/h6-18H,4-5,19-20,22H2,1-3H3 |
PubChem CID | 44276513 |
ChEMBL | CHEMBL286520 |
IUPHAR | N/A |
BindingDB | 50126263 |
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 |
---|---|---|---|---|---|
42325 | B2 bradykinin receptor | P30411 | BDKRB2 | Homo sapiens (Human) | 391 |
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