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Ligand

NameCHEMBL274038
Molecular formulaC31H32ClN2NaO2S
IUPAC namesodium;(6S)-6-[3-[2-(7-chloroquinolin-2-yl)ethyl]phenyl]-3,3-dimethyl-6-(pyridin-2-ylmethylsulfanyl)hexanoate
Molecular weight555.109
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogPNone
SynonymsN/A
Inchi KeyATQKBMWPOHXARU-JMAPEOGHSA-M
Inchi IDInChI=1S/C31H33ClN2O2S.Na/c1-31(2,20-30(35)36)16-15-29(37-21-27-8-3-4-17-33-27)24-7-5-6-22(18-24)9-13-26-14-11-23-10-12-25(32)19-28(23)34-26;/h3-8,10-12,14,17-19,29H,9,13,15-16,20-21H2,1-2H3,(H,35,36);/q;+1/p-1/t29-;/m0./s1
PubChem CID44269382
ChEMBLCHEMBL274038
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14223Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340

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