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Ligand

NameCHEMBL85729
Molecular formulaC14H25N3O2
IUPAC nameN-[(E)-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-ylidene)amino]-2-methylpropanamide
Molecular weight267.373
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP1.3
SynonymsBDBM50288154
Isobutyric acid [2,8-dimethyl-1-oxa-8-aza-spiro[4.5]dec-(3E)-ylidene]-hydrazide
Inchi KeyBYACNXAWOKBQLX-NTCAYCPXSA-N
Inchi IDInChI=1S/C14H25N3O2/c1-10(2)13(18)16-15-12-9-14(19-11(12)3)5-7-17(4)8-6-14/h10-11H,5-9H2,1-4H3,(H,16,18)/b15-12+
PubChem CID44318712
ChEMBLCHEMBL85729
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35601Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
35602Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466

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