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Name | AC1MXB69 |
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Molecular formula | C21H15F3N4O5 |
IUPAC name | 2-methoxy-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide |
Molecular weight | 460.369 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 1.8 |
Synonyms | 714232-55-0 MCULE-8478594131 AKOS005705160 N-[4-hydroxy-2,6-dioxo-1-phenyl-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-methoxybenzamide 2-methoxy-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide [ Show all ] |
Inchi Key | AHSAASFIYMEYDM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H15F3N4O5/c1-33-13-10-6-5-9-12(13)16(29)27-20(21(22,23)24)14-15(25-18(20)31)28(19(32)26-17(14)30)11-7-3-2-4-8-11/h2-10H,1H3,(H,25,31)(H,27,29)(H,26,30,32) |
PubChem CID | 3762857 |
ChEMBL | CHEMBL1518693 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
463585 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218