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Ligand

NameCHEMBL565630
Molecular formulaC16H15ClN2
IUPAC name2-[benzyl-[(3-chlorophenyl)methyl]amino]acetonitrile
Molecular weight270.76
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP3.7
SynonymsSCHEMBL5703543
Inchi KeyDNSQESMZEDAMPW-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H15ClN2/c17-16-8-4-7-15(11-16)13-19(10-9-18)12-14-5-2-1-3-6-14/h1-8,11H,10,12-13H2
PubChem CID10423292
ChEMBLCHEMBL565630
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
64621Substance-K receptorP16610Tacr2Rattus norvegicus (Rat)390

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