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Ligand

NameCHEMBL3770278
Molecular formulaC18H19ClN4O3S
IUPAC name2-[1-[5-(3-chloro-4-propan-2-yloxyphenyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethylpyrazol-4-yl]acetic acid
Molecular weight406.885
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.0
SynonymsBDBM50149555
Inchi KeyAJIKYUOKNHOLKA-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19ClN4O3S/c1-9(2)26-15-6-5-12(7-14(15)19)17-20-21-18(27-17)23-11(4)13(8-16(24)25)10(3)22-23/h5-7,9H,8H2,1-4H3,(H,24,25)
PubChem CID127029099
ChEMBLCHEMBL3770278
IUPHARN/A
BindingDB50149555
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
521650Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
521651Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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