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Ligand

NameCHEMBL49932
Molecular formulaC22H21N5O2
IUPAC name7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene
Molecular weight387.443
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.7
SynonymsBDBM50408168
SCHEMBL8564383
Inchi KeyAZJGEHAZLNOBGW-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H21N5O2/c1-3-17-21(23-7-1)27-8-2-4-18(27)22(24-17)26-11-9-25(10-12-26)14-16-5-6-19-20(13-16)29-15-28-19/h1-8,13H,9-12,14-15H2
PubChem CID10548259
ChEMBLCHEMBL49932
IUPHARN/A
BindingDB50408168
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
182075-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
182115-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
182095-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
182105-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
182085-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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