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Ligand

NameSMR000032959
Molecular formulaC20H22ClN5O3
IUPAC name5-(3-chloro-4-ethoxyphenyl)-7-(2,3-dimethoxyphenyl)-4,5,6,7-tetrahydrotetrazolo[1,5-a]pyrimidine
Molecular weight415.878
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.1
SynonymsAC1NY9EU
HMS2168M04
BDBM37075
MLS000046948
STL193210
[ Show all ]
Inchi KeyAINBGVWINWHKGP-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22ClN5O3/c1-4-29-17-9-8-12(10-14(17)21)15-11-16(26-20(22-15)23-24-25-26)13-6-5-7-18(27-2)19(13)28-3/h5-10,15-16H,4,11H2,1-3H3,(H,22,23,25)
PubChem CID3243199
ChEMBLCHEMBL1411576
IUPHARN/A
BindingDB37075
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
6375Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
6376Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382

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