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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 CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameCHEMBL607689
Molecular formulaC20H22FN3
IUPAC name2-[[4-(2-fluorophenyl)piperidin-1-yl]methyl]-1-methylbenzimidazole
Molecular weight323.415
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.6
Synonyms(4-(2-fluorophenyl)piperidin-1-ylmethyl)-1-methyl-1H-benzo[d]imidazole
2-((4-(2-Fluorophenyl)piperidin-1-yl)methyl)-1-methyl-1H-benzo-[d]imidazole
2-((4-(2-fluorophenyl)piperidin-1-yl)methyl)-1-methyl-1H-benzo[d]imidazole
AMADNKXMEDYTCS-UHFFFAOYSA-N
BDBM50343299
Inchi KeyAMADNKXMEDYTCS-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22FN3/c1-23-19-9-5-4-8-18(19)22-20(23)14-24-12-10-15(11-13-24)16-6-2-3-7-17(16)21/h2-9,15H,10-14H2,1H3
PubChem CID24815439
ChEMBLCHEMBL607689
IUPHARN/A
BindingDB50343299
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8691D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
8696D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
8697D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
8693Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
8692Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
8695Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872
8694Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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