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Ligand

NameCHEMBL10074
Molecular formulaC16H18ClN3S
IUPAC name2-[[4-(4-chlorophenyl)sulfanylphenyl]methyl]-1-ethylguanidine
Molecular weight319.851
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP3.8
SynonymsGuanidine, N-[[4-[(4-chlorophenyl)thio]phenyl]methyl]-N'-ethyl-
BDBM50223827
CTK1J3012
677343-07-6
SCHEMBL5788743
[ Show all ]
Inchi KeyBLIVNBAXZXXNGZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H18ClN3S/c1-2-19-16(18)20-11-12-3-7-14(8-4-12)21-15-9-5-13(17)6-10-15/h3-10H,2,11H2,1H3,(H3,18,19,20)
PubChem CID11415934
ChEMBLCHEMBL10074
IUPHARN/A
BindingDB50223827
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
26683Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386

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