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Ligand

NameCHEMBL63845
Molecular formulaC20H17F3N4S
IUPAC name8-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
Molecular weight402.439
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP5.8
SynonymsSCHEMBL7296642
BDBM50407768
5-[4-[3-(Trifluoromethyl)phenyl]piperazine-1-yl]-3-thia-4,8a-diaza-as-indacene
Inchi KeyHGYNWZFKHCMJGM-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H17F3N4S/c21-20(22,23)14-3-1-4-15(13-14)25-8-10-26(11-9-25)18-16-5-2-7-27(16)17-6-12-28-19(17)24-18/h1-7,12-13H,8-11H2
PubChem CID10573164
ChEMBLCHEMBL63845
IUPHARN/A
BindingDB50407768
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1147055-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1147045-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
1147025-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
1147015-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
1147035-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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