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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL1271756
Molecular formulaC22H30Cl3N5O
IUPAC nameN-[3-[4-(2,3-dichlorophenyl)piperazin-1-yl]propyl]-2-methyl-6-propan-2-ylpyrimidine-4-carboxamide;hydrochloride
Molecular weight486.866
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogPNone
SynonymsN/A
Inchi KeyACMANAOGOCCODN-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H29Cl2N5O.ClH/c1-15(2)18-14-19(27-16(3)26-18)22(30)25-8-5-9-28-10-12-29(13-11-28)20-7-4-6-17(23)21(20)24;/h4,6-7,14-15H,5,8-13H2,1-3H3,(H,25,30);1H
PubChem CID50899744
ChEMBLCHEMBL1271756
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16895-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
16885-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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