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Name | 125-71-3 |
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Molecular formula | C18H25NO |
IUPAC name | (1R,9R,10S)-4-methoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene |
Molecular weight | 271.404 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 0 |
XlogP | 3.4 |
Synonyms | AKOS016014075 Robitussin, Delsym, DM, DexAlone, Duract AX8017886 SCHEMBL248575 (4bR,8aS,9R)-3-Methoxy-11-methyl-6,7,8,8a,9,10-hexahydro-5H-9,4b-(epiminoethano)phenanthrene [ Show all ] |
Inchi Key | MKXZASYAUGDDCJ-KBAYOESNSA-N |
Inchi ID | InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17-,18-/m1/s1 |
PubChem CID | 6916184 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 213826 |
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 |
---|---|---|---|---|---|
527486 | Mas-related G-protein coupled receptor member X2 | Q96LB1 | MRGPRX2 | Homo sapiens (Human) | 330 |
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