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Name | CHEMBL328573 |
---|---|
Molecular formula | C19H22N2O |
IUPAC name | N,N-dimethyl-1-[(4S,6R)-3-oxa-2-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7,9,11,14,16-hexaen-4-yl]methanamine |
Molecular weight | 294.398 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 3.9 |
Synonyms | N,N-Dimethyl-2,3,3abeta,8-tetrahydro-1-oxa-12b-azadibenzo[e,h]azulene-2alpha-methanamine SCHEMBL7858917 BDBM50146360 Dimethyl-[(2S,3aR)-1-(2,3,3a,8-tetrahydro-1-oxa-12b-aza-dibenzo[e,h]azulen-2-yl)methyl]-amine |
Inchi Key | BTSCZNWXJQSJIE-QFBILLFUSA-N |
Inchi ID | InChI=1S/C19H22N2O/c1-20(2)13-16-12-19-17-9-5-3-7-14(17)11-15-8-4-6-10-18(15)21(19)22-16/h3-10,16,19H,11-13H2,1-2H3/t16-,19+/m0/s1 |
PubChem CID | 9839081 |
ChEMBL | CHEMBL328573 |
IUPHAR | N/A |
BindingDB | 50146360 |
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 |
---|---|---|---|---|---|
32636 | 5-hydroxytryptamine receptor 1A | P08908 | HTR1A | Homo sapiens (Human) | 422 |
32635 | 5-hydroxytryptamine receptor 1D | P28221 | HTR1D | Homo sapiens (Human) | 377 |
32631 | 5-hydroxytryptamine receptor 2A | P28223 | HTR2A | Homo sapiens (Human) | 471 |
32630 | 5-hydroxytryptamine receptor 2C | P28335 | HTR2C | Homo sapiens (Human) | 458 |
32641 | Alpha-1A adrenergic receptor | P35348 | ADRA1A | Homo sapiens (Human) | 466 |
32633 | Alpha-2A adrenergic receptor | P08913 | ADRA2A | Homo sapiens (Human) | 450 |
32632 | Alpha-2C adrenergic receptor | P18825 | ADRA2C | Homo sapiens (Human) | 462 |
32642 | Beta-3 adrenergic receptor | P13945 | ADRB3 | Homo sapiens (Human) | 408 |
32637 | D(2) dopamine receptor | P61169 | Drd2 | Rattus norvegicus (Rat) | 444 |
32639 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
32638 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
32640 | D(4) dopamine receptor | P21917 | DRD4 | Homo sapiens (Human) | 467 |
32634 | Histamine H1 receptor | P35367 | HRH1 | Homo sapiens (Human) | 487 |
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