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Name | Azatadine M (nor), acetylated |
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Molecular formula | C21H22N2O |
IUPAC name | 1-[4-(4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ylidene)piperidin-1-yl]ethanone |
Molecular weight | 318.42 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 0 |
XlogP | 3.0 |
Synonyms | AC1LAYV0 5,6-Dihydro-11-(1-acetyl-4-piperidinylidene)-11H-benzo[5,6]cyclohepta[1,2-b]pyridine SCHEMBL8877892 CHEMBL140483 BDBM50007467 [ Show all ] |
Inchi Key | DUBAGCAHNNYUJQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H22N2O/c1-15(24)23-13-10-17(11-14-23)20-19-7-3-2-5-16(19)8-9-18-6-4-12-22-21(18)20/h2-7,12H,8-11,13-14H2,1H3 |
PubChem CID | 524022 |
ChEMBL | CHEMBL140483 |
IUPHAR | N/A |
BindingDB | 50007467 |
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 |
---|---|---|---|---|---|
68850 | Histamine H1 receptor | P31390 | Hrh1 | Rattus norvegicus (Rat) | 486 |
68849 | Platelet-activating factor receptor | P25105 | PTAFR | Homo sapiens (Human) | 342 |
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