5,6-Dibromotryptamine; Nb,Nb-Di-Me
AlkaPlorer ID: AK047512
Synonym: 5,6-Dibromo-Nb,Nb-dimethyltryptamine, 5,6-Dibromo-N,N-dimethyl-1H-indole-3-ethanamine
IUPAC Name: 2-(5,6-dibromo-1H-indol-3-yl)-N,N-dimethylethanamine
Structure
SMILES: CN(C)CCC1=CNC2=CC(Br)=C(Br)C=C12
InChI: InChI=1S/C12H14Br2N2/c1-16(2)4-3-8-7-15-12-6-11(14)10(13)5-9(8)12/h5-7,15H,3-4H2,1-2H3
InChIKey: FQUXASLSQLXGHJ-UHFFFAOYSA-N
Reference
PubChem CID: 360251
CAS: 72853-80-6
LOTUS: LTS0003854
NPASS: NPC149265
COCONUT: CNP0165603
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Verongula gigantea | Verongula | Aplysinidae | Verongiida | Demospongiae | Porifera | Metazoa | Eukaryota |
| Smenospongia aurea | Smenospongia | Thorectidae | Dictyoceratida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 346.066
TPSA？: 19.03
MolLogP？: 3.7970000000000015
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Gallus gallus | Gallus gallus | Activity | nan | None | 10.1021/np070371u |
| Homo sapiens | Endothelin receptor ET-A | Activity | 62.0 | % | 10.1021/np900287e |
| Homo sapiens | Endothelin receptor ET-A | Activity | 100.0 | % | 10.1021/np900287e |
| Homo sapiens | Neuropeptide Y receptor type 1 | Activity | 17.0 | % | 10.1021/np900287e |
| Homo sapiens | Neuropeptide Y receptor type 1 | Activity | 100.0 | % | 10.1021/np900287e |
| Mus musculus | Mus musculus | Activity | nan | None | 10.1021/np070371u |