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Name | CHEMBL390272 |
---|---|
Molecular formula | C26H19BrN6O3 |
IUPAC name | 3-benzamido-4-bromo-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)-1H-pyrazole-5-carboxamide |
Molecular weight | 543.381 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 4 |
XlogP | 4.0 |
Synonyms | BDBM50222686 SCHEMBL6045808 5-(benzoylamino)-4-bromo-N-(2,3-dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-1H-pyrazole-3-carboxamide |
Inchi Key | BEPXHHMZTMDGJY-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H19BrN6O3/c27-19-21(32-33-22(19)30-24(34)16-11-5-2-6-12-16)25(35)31-23-26(36)28-18-14-8-7-13-17(18)20(29-23)15-9-3-1-4-10-15/h1-14,23H,(H,28,36)(H,31,35)(H2,30,32,33,34) |
PubChem CID | 23630513 |
ChEMBL | CHEMBL390272 |
IUPHAR | N/A |
BindingDB | 50222686 |
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 |
---|---|---|---|---|---|
21799 | B1 bradykinin receptor | P46663 | BDKRB1 | Homo sapiens (Human) | 353 |
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