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Ligand

NameCHEMBL481001
Molecular formulaC30H36FN5O
IUPAC name[2-[5-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]pyridin-2-yl]phenyl]-[4-(4-fluoroanilino)piperidin-1-yl]methanone
Molecular weight501.65
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.4
SynonymsBDBM50412528
Inchi KeyCEXBQWBYMNLJFT-SZPZYZBQSA-N
Inchi IDInChI=1S/C30H36FN5O/c1-21-18-35(19-22(2)33-21)20-23-7-12-29(32-17-23)27-5-3-4-6-28(27)30(37)36-15-13-26(14-16-36)34-25-10-8-24(31)9-11-25/h3-12,17,21-22,26,33-34H,13-16,18-20H2,1-2H3/t21-,22+
PubChem CID44570567
ChEMBLCHEMBL481001
IUPHARN/A
BindingDB50412528
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
40367Motilin receptorO43193MLNRHomo sapiens (Human)412

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