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Name | CHEMBL1834751 |
---|---|
Molecular formula | C31H31F2N5O2 |
IUPAC name | 6-(5,8-difluoro-4-methyl-1-oxophthalazin-2-yl)-N-[(1R)-6-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-3-carboxamide |
Molecular weight | 543.619 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 4.5 |
Synonyms | BDBM50355057 |
Inchi Key | RNZVZOQUASDNJY-AREMUKBSSA-N |
Inchi ID | InChI=1S/C31H31F2N5O2/c1-19-28-24(32)11-12-25(33)29(28)31(40)38(36-19)27-13-9-22(17-34-27)30(39)35-26-7-5-6-21-16-20(8-10-23(21)26)18-37-14-3-2-4-15-37/h8-13,16-17,26H,2-7,14-15,18H2,1H3,(H,35,39)/t26-/m1/s1 |
PubChem CID | 56589598 |
ChEMBL | CHEMBL1834751 |
IUPHAR | N/A |
BindingDB | 50355057 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
300977 | B1 bradykinin receptor | P48748 | BDKRB1 | Oryctolagus cuniculus (Rabbit) | 352 |
300978 | B1 bradykinin receptor | P46663 | BDKRB1 | Homo sapiens (Human) | 353 |
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