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Name | SCHEMBL4274851 |
---|---|
Molecular formula | C17H18N2 |
IUPAC name | (3aR,4S,9bS)-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-c]quinoline |
Molecular weight | 250.345 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 2 |
XlogP | 3.0 |
Synonyms | (3aR,4S,9bS*)-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-c]quinoline MWBAPPROCDENMS-USXIJHARSA-N (3aR*,4S*,9bS)-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-c]quinoline (3aR*,4S*,9bS*)-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-c]quinoline CHEMBL3797265 |
Inchi Key | MWBAPPROCDENMS-USXIJHARSA-N |
Inchi ID | InChI=1S/C17H18N2/c1-2-6-12(7-3-1)16-14-10-11-18-17(14)13-8-4-5-9-15(13)19-16/h1-9,14,16-19H,10-11H2/t14-,16+,17+/m0/s1 |
PubChem CID | 57846973 |
ChEMBL | CHEMBL3797265 |
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 |
---|---|---|---|---|---|
527693 | G-protein coupled estrogen receptor 1 | Q99527 | GPER1 | Homo sapiens (Human) | 375 |
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