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Ligand

NameCHEMBL270865
Molecular formulaC20H24ClN5O2S2
IUPAC nameN-[(2S)-1-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]propan-2-yl]-7-methylthieno[3,2-d]pyrimidin-4-amine
Molecular weight466.015
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP3.7
SynonymsBDBM50373827
Inchi KeyIBFNFMRLJWZZFU-HNNXBMFYSA-N
Inchi IDInChI=1S/C20H24ClN5O2S2/c1-14-12-29-19-18(14)22-13-23-20(19)24-15(2)11-25-6-8-26(9-7-25)30(27,28)17-5-3-4-16(21)10-17/h3-5,10,12-13,15H,6-9,11H2,1-2H3,(H,22,23,24)/t15-/m0/s1
PubChem CID44454091
ChEMBLCHEMBL270865
IUPHARN/A
BindingDB50373827
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
129052Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351

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