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Name | CHEMBL2371826 |
---|---|
Molecular formula | C21H25F3N6O7 |
IUPAC name | 1-[(2S)-3-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-oxo-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propyl]pyridin-1-ium-3-carboxamide;2,2,2-trifluoroacetate |
Molecular weight | 530.461 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 4 |
XlogP | None |
Synonyms | N/A |
Inchi Key | BQBBAKFIEQKJAL-JKBZPBJLSA-N |
Inchi ID | InChI=1S/C19H24N6O5.C2HF3O2/c20-16(27)11-3-1-7-24(9-11)10-13(23-18(29)12-5-6-15(26)22-12)19(30)25-8-2-4-14(25)17(21)28;3-2(4,5)1(6)7/h1,3,7,9,12-14H,2,4-6,8,10H2,(H5-,20,21,22,23,26,27,28,29);(H,6,7)/t12-,13-,14-;/m0./s1 |
PubChem CID | 73356247 |
ChEMBL | CHEMBL2371826 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
30095 | Thyrotropin-releasing hormone receptor | Q01717 | Trhr | Rattus norvegicus (Rat) | 412 |
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