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Name | CHEMBL556816 |
---|---|
Molecular formula | C25H21BrCl3N5O3 |
IUPAC name | N-[3-[(3-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)oxymethyl]-2,4-dichlorophenyl]-2-[(3-chlorophenyl)carbamoylamino]-N-methylacetamide |
Molecular weight | 625.729 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 6.6 |
Synonyms | CHEMBL1196403 N-[3-(3-Bromo-2-methyl-imidazo[1,2-a]pyridin-8-yloxymethyl)-2,4-dichloro-phenyl]-2-[3-(3-chloro-phenyl)-ureido]-N-methyl-acetamide; hydrochloride SCHEMBL8559745 BDBM50067261 N-[2-[Methyl[2,4-dichloro-3-[[(2-methyl-3-bromoimidazo[1,2-a]pyridine-8-yl)oxy]methyl]phenyl]amino]-2-oxoethyl]-N'-(3-chlorophenyl)urea |
Inchi Key | HKAFQVKVFBWIJW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H21BrCl3N5O3/c1-14-23(26)34-10-4-7-20(24(34)31-14)37-13-17-18(28)8-9-19(22(17)29)33(2)21(35)12-30-25(36)32-16-6-3-5-15(27)11-16/h3-11H,12-13H2,1-2H3,(H2,30,32,36) |
PubChem CID | 10841637 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50067261 |
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 |
---|---|---|---|---|---|
117020 | B2 bradykinin receptor | P30411 | BDKRB2 | Homo sapiens (Human) | 391 |
117021 | B2 bradykinin receptor | O70526 | BDKRB2 | Cavia porcellus (Guinea pig) | 372 |
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