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Ligand

NameSMR000006848
Molecular formulaC18H20N4O
IUPAC nameN-[2-[(3-cyano-7,8-dimethylquinolin-2-yl)amino]ethyl]cyclopropanecarboxamide
Molecular weight308.385
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.3
SynonymsN-[2-[(3-cyano-7,8-dimethyl-2-quinolyl)amino]ethyl]cyclopropanecarboxamide
BDBM74551
cid_648434
MLS000033154
ZINC20151399
[ Show all ]
Inchi KeyADYKIWQYRJDHRU-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20N4O/c1-11-3-4-14-9-15(10-19)17(22-16(14)12(11)2)20-7-8-21-18(23)13-5-6-13/h3-4,9,13H,5-8H2,1-2H3,(H,20,22)(H,21,23)
PubChem CID648434
ChEMBLCHEMBL1328534
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3223Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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