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Ligand

NameCHEMBL3290094
Molecular formulaC31H33ClN4O5
IUPAC name(2S)-2-[[1-(7-chloroquinolin-4-yl)-5-(2,6-dimethoxyphenyl)-4-ethylpyrazole-3-carbonyl]amino]-2-cyclohexylacetic acid
Molecular weight577.078
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP6.8
SynonymsBDBM50019410
SCHEMBL18983529
Inchi KeyWZQNVNSPKOSEAU-MHZLTWQESA-N
Inchi IDInChI=1S/C31H33ClN4O5/c1-4-20-28(30(37)34-27(31(38)39)18-9-6-5-7-10-18)35-36(23-15-16-33-22-17-19(32)13-14-21(22)23)29(20)26-24(40-2)11-8-12-25(26)41-3/h8,11-18,27H,4-7,9-10H2,1-3H3,(H,34,37)(H,38,39)/t27-/m0/s1
PubChem CID90644387
ChEMBLCHEMBL3290094
IUPHARN/A
BindingDB50019410
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
386453Neurotensin receptor type 1P20789Ntsr1Rattus norvegicus (Rat)424
386454Neurotensin receptor type 2Q63384Ntsr2Rattus norvegicus (Rat)416

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