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Name | CHEMBL3600445 |
---|---|
Molecular formula | C23H23I2N7O3 |
IUPAC name | N-[(2S)-3-(1-benzyl-2,5-diiodoimidazol-4-yl)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopropan-2-yl]pyrazine-2-carboxamide |
Molecular weight | 699.292 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 1.5 |
Synonyms | BDBM50109026 (Pyrazine-2-ylcarbonyl)-2,5-diiodo-1-benzyl-L-His-L-Pro-NH2 |
Inchi Key | CCRWOBIVNBYGCX-WMZOPIPTSA-N |
Inchi ID | InChI=1S/C23H23I2N7O3/c24-19-15(30-23(25)32(19)13-14-5-2-1-3-6-14)11-16(29-21(34)17-12-27-8-9-28-17)22(35)31-10-4-7-18(31)20(26)33/h1-3,5-6,8-9,12,16,18H,4,7,10-11,13H2,(H2,26,33)(H,29,34)/t16-,18-/m0/s1 |
PubChem CID | 122184245 |
ChEMBL | CHEMBL3600445 |
IUPHAR | N/A |
BindingDB | 50109026 |
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 |
---|---|---|---|---|---|
467704 | Thyrotropin-releasing hormone receptor | P21761 | Trhr | Mus musculus (Mouse) | 393 |
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