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Ligand

NameBDBM79970
Molecular formulaC17H19N5O2S
IUPAC name3-(1-cyclohexyltetrazol-5-yl)sulfanyl-1-phenylpyrrole-2,5-diol
Molecular weight357.432
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.0
Synonyms3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-phenyl-pyrrolidine-2,5-dione
3-[(1-cyclohexyl-5-tetrazolyl)thio]-1-phenylpyrrolidine-2,5-dione
3-[(1-cyclohexyltetrazol-5-yl)thio]-1-phenyl-pyrrolidine-2,5-quinone
cid_2973118
Inchi KeyAWFKRCSXWSVESV-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H19N5O2S/c23-15-11-14(16(24)21(15)12-7-3-1-4-8-12)25-17-18-19-20-22(17)13-9-5-2-6-10-13/h1,3-4,7-8,11,13,23-24H,2,5-6,9-10H2
PubChem CID136664533
ChEMBLN/A
IUPHARN/A
BindingDB79970
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
557720C-C chemokine receptor type 6P51684CCR6Homo sapiens (Human)374

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