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Ligand

Name4-phenyl-3-buten-2-one thiosemicarbazone
Molecular formulaC11H13N3S
IUPAC name[(E)-[(E)-4-phenylbut-3-en-2-ylidene]amino]thiourea
Molecular weight219.306
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP1.8
Synonyms81226-84-8
NSC306890
NSC 306890
AC1NTKD9
Probes1_000386
[ Show all ]
Inchi KeyAIVYBZNYDAYFOK-NJHPPEEMSA-N
Inchi IDInChI=1S/C11H13N3S/c1-9(13-14-11(12)15)7-8-10-5-3-2-4-6-10/h2-8H,1H3,(H3,12,14,15)/b8-7+,13-9+
PubChem CID5405847
ChEMBLCHEMBL1994401
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
6572Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
6573Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
6574Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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