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Ligand

NameCHEMBL480219
Molecular formulaC28H35FN6O
IUPAC name[1-[4-[[(3R,5S)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]imidazol-2-yl]-[4-(3-fluoroanilino)piperidin-1-yl]methanone
Molecular weight490.627
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50255029
SCHEMBL5127680
{1-[4-((3R,5S)-3,5-Dimethyl-piperazin-1-ylmethyl)-phenyl]-1H-imidazol-2-yl}-[4-(3-fluoro-phenylamino)-piperidin-1-yl]-methanone
Inchi KeyBKNPWPRZETXJRA-OYRHEFFESA-N
Inchi IDInChI=1S/C28H35FN6O/c1-20-17-33(18-21(2)31-20)19-22-6-8-26(9-7-22)35-15-12-30-27(35)28(36)34-13-10-24(11-14-34)32-25-5-3-4-23(29)16-25/h3-9,12,15-16,20-21,24,31-32H,10-11,13-14,17-19H2,1-2H3/t20-,21+
PubChem CID16041292
ChEMBLCHEMBL480219
IUPHARN/A
BindingDB50255029
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
25953Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366
25952Motilin receptorO43193MLNRHomo sapiens (Human)412

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