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Name | CHEMBL2018868 |
---|---|
Molecular formula | C35H36N4O3S |
IUPAC name | N-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]ethyl]-2-[5-(2,4,5-trimethylphenyl)sulfonyl-6H-phenanthridin-6-yl]acetamide |
Molecular weight | 592.758 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 5.1 |
Synonyms | BDBM50381270 |
Inchi Key | FJYKKDSINJTGDP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C35H36N4O3S/c1-23-20-25(3)33(21-24(23)2)43(41,42)39-31-11-7-6-9-29(31)28-8-4-5-10-30(28)32(39)22-34(40)36-17-16-26-12-14-27(15-13-26)35-37-18-19-38-35/h4-15,20-21,32H,16-19,22H2,1-3H3,(H,36,40)(H,37,38) |
PubChem CID | 70691814 |
ChEMBL | CHEMBL2018868 |
IUPHAR | N/A |
BindingDB | 50381270 |
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 |
---|---|---|---|---|---|
80183 | B1 bradykinin receptor | P97583 | Bdkrb1 | Rattus norvegicus (Rat) | 337 |
80184 | B1 bradykinin receptor | P46663 | BDKRB1 | Homo sapiens (Human) | 353 |
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