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Name | CHEMBL301705 |
---|---|
Molecular formula | C29H30N4O5 |
IUPAC name | 2-butyl-3-[[4-[[(2S)-2-(2-carboxypyrrol-1-yl)-3-phenylpropanoyl]amino]phenyl]methyl]imidazole-4-carboxylic acid |
Molecular weight | 514.582 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 4.8 |
Synonyms | BDBM50047929 2-Butyl-3-{4-[2-(2-carboxy-pyrrol-1-yl)-3-phenyl-propionylamino]-benzyl}-3H-imidazole-4-carboxylic acid 1-[4-[[(S)-1-Oxo-2-benzyl-2-[2-carboxy-1H-pyrrol-1-yl]ethyl]amino]benzyl]-2-butyl-1H-imidazole-5-carboxylic acid |
Inchi Key | GRBUICWYQXVYKZ-DEOSSOPVSA-N |
Inchi ID | InChI=1S/C29H30N4O5/c1-2-3-11-26-30-18-25(29(37)38)33(26)19-21-12-14-22(15-13-21)31-27(34)24(17-20-8-5-4-6-9-20)32-16-7-10-23(32)28(35)36/h4-10,12-16,18,24H,2-3,11,17,19H2,1H3,(H,31,34)(H,35,36)(H,37,38)/t24-/m0/s1 |
PubChem CID | 15356436 |
ChEMBL | CHEMBL301705 |
IUPHAR | N/A |
BindingDB | 50047929 |
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 |
---|---|---|---|---|---|
103236 | Type-1B angiotensin II receptor | P29089 | Agtr1b | Rattus norvegicus (Rat) | 359 |
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