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Ligand

NameSCHEMBL2712319
Molecular formulaC19H21ClN4O2
IUPAC name8-[5-chloro-4-(3-methylpyridin-2-yl)pyridin-2-yl]-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Molecular weight372.853
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.9
SynonymsUS9056865, A-20
CHEMBL3692725
BDBM162893
Inchi KeyANFTXFNLBJITGH-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H21ClN4O2/c1-13-4-3-7-21-17(13)14-10-16(22-11-15(14)20)24-8-5-19(6-9-24)12-23(2)18(25)26-19/h3-4,7,10-11H,5-6,8-9,12H2,1-2H3
PubChem CID67508089
ChEMBLCHEMBL3692725
IUPHARN/A
BindingDB162893
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
459298Smoothened homologQ99835SMOHomo sapiens (Human)787

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