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Ligand

Name3-{(2E)-2-[(4,6-dichloro-2H-thiochromen-3-yl)methylene]hydrazino}benzoic acid
Molecular formulaC17H12Cl2N2O2S
IUPAC name3-[(2E)-2-[(4,6-dichloro-2H-thiochromen-3-yl)methylidene]hydrazinyl]benzoic acid
Molecular weight379.255
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.6
SynonymsCHEMBL3196867
MolPort-003-704-656
AKOS002075589
Inchi KeyAGVUNFQPIWHNIU-DNTJNYDQSA-N
Inchi IDInChI=1S/C17H12Cl2N2O2S/c18-12-4-5-15-14(7-12)16(19)11(9-24-15)8-20-21-13-3-1-2-10(6-13)17(22)23/h1-8,21H,9H2,(H,22,23)/b20-8+
PubChem CID9689554
ChEMBLCHEMBL3196867
IUPHARN/A
BindingDBN/A
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
463515Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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