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Ligand

NameCHEMBL1770355
Molecular formulaC17H19N5O5
IUPAC name2-[[(2S)-2-amino-3-[3-(5-hydroxypyridin-2-yl)-1,2,4-oxadiazol-5-yl]propanoyl]amino]cyclohexene-1-carboxylic acid
Molecular weight373.369
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP-1.7
SynonymsBDBM50342527
SCHEMBL13934006
(S)-2-(2-amino-3-(3-(5-hydroxypyridin-2-yl)-1,2,4-oxadiazol-5-yl)propanamido)cyclohex-1-enecarboxylic acid
Inchi KeyBHNQCBPLZXKWKH-NSHDSACASA-N
Inchi IDInChI=1S/C17H19N5O5/c18-11(16(24)20-12-4-2-1-3-10(12)17(25)26)7-14-21-15(22-27-14)13-6-5-9(23)8-19-13/h5-6,8,11,23H,1-4,7,18H2,(H,20,24)(H,25,26)/t11-/m0/s1
PubChem CID136088960
ChEMBLCHEMBL1770355
IUPHARN/A
BindingDB50342527
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
558014Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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