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Ligand

NameCHEMBL418678
Molecular formulaC20H19FN4S
IUPAC name8-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene
Molecular weight366.458
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.7
SynonymsBDBM50407772
5-[4-(4-Fluorobenzyl)-1-piperazinyl]pyrrolo[1,2-a]thieno[3,2-e]pyrazine
Inchi KeyANJGZJUIHVVPCI-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19FN4S/c21-16-5-3-15(4-6-16)14-23-9-11-24(12-10-23)19-18-2-1-8-25(18)20-17(22-19)7-13-26-20/h1-8,13H,9-12,14H2
PubChem CID11793287
ChEMBLCHEMBL418678
IUPHARN/A
BindingDB50407772
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
96175-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
96165-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
96135-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
96145-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
96155-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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