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Ligand

NameCHEMBL2059222
Molecular formulaC11H14N2O2
IUPAC name(2R,3R,4S)-3-propyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene-7-carboxylic acid
Molecular weight206.245
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.1
SynonymsBDBM50388199
SCHEMBL13631588
Inchi KeyCSMSFPLNDIGDBG-GKROBHDKSA-N
Inchi IDInChI=1S/C11H14N2O2/c1-2-3-5-6-4-7-9(8(5)6)12-13-10(7)11(14)15/h5-6,8H,2-4H2,1H3,(H,12,13)(H,14,15)/t5-,6+,8-/m1/s1
PubChem CID57413446
ChEMBLCHEMBL2059222
IUPHARN/A
BindingDB50388199
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
49580Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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