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Name | Carabersat |
---|---|
Molecular formula | C20H20FNO4 |
IUPAC name | N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-4-fluorobenzamide |
Molecular weight | 357.381 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 2.3 |
Synonyms | (3R,4S)-6-Acetyl-4-(4-fluorobenzamido)-3,4-dihydro-2,2-dimethyl-3-hydroxy-2H-1-benzopyran CHEMBL39933 K9R83652CK SB-204268 SB-258339 [ Show all ] |
Inchi Key | RCLXAPJEFHPYEG-ZWKOTPCHSA-N |
Inchi ID | InChI=1S/C20H20FNO4/c1-11(23)13-6-9-16-15(10-13)17(18(24)20(2,3)26-16)22-19(25)12-4-7-14(21)8-5-12/h4-10,17-18,24H,1-3H3,(H,22,25)/t17-,18+/m0/s1 |
PubChem CID | 193943 |
ChEMBL | CHEMBL39933 |
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 |
---|---|---|---|---|---|
292845 | 5-hydroxytryptamine receptor 1D | Q61224 | Htr1d | Mus musculus (Mouse) | 374 |
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