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Ligand

NameCHEMBL3290091
Molecular formulaC29H29ClN4O5
IUPAC name(2S)-2-[[1-(7-chloroquinolin-4-yl)-5-(2,4-dimethoxyphenyl)pyrazole-3-carbonyl]amino]-2-cyclohexylacetic acid
Molecular weight549.024
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP6.0
SynonymsBDBM50019407
SCHEMBL17114566
Inchi KeyHFQAFXRLXRULMH-MHZLTWQESA-N
Inchi IDInChI=1S/C29H29ClN4O5/c1-38-19-9-11-21(26(15-19)39-2)25-16-23(28(35)32-27(29(36)37)17-6-4-3-5-7-17)33-34(25)24-12-13-31-22-14-18(30)8-10-20(22)24/h8-17,27H,3-7H2,1-2H3,(H,32,35)(H,36,37)/t27-/m0/s1
PubChem CID90644384
ChEMBLCHEMBL3290091
IUPHARN/A
BindingDB50019407
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
113661Neurotensin receptor type 1P20789Ntsr1Rattus norvegicus (Rat)424
113660Neurotensin receptor type 2Q63384Ntsr2Rattus norvegicus (Rat)416

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