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Ligand

NameCHEMBL52800
Molecular formulaC22H22FN5O
IUPAC name7-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-12-methoxy-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene
Molecular weight391.45
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.3
SynonymsSCHEMBL8565934
BDBM50408156
Inchi KeyARCIIEQRTPPAQU-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22FN5O/c1-29-20-9-8-18-21(25-20)28-10-2-3-19(28)22(24-18)27-13-11-26(12-14-27)15-16-4-6-17(23)7-5-16/h2-10H,11-15H2,1H3
PubChem CID10715484
ChEMBLCHEMBL52800
IUPHARN/A
BindingDB50408156
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
123015-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
123045-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
123035-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
123025-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
123005-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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