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Ligand

NameCHEMBL61498
Molecular formulaC18H27N3O2
IUPAC name(2S)-1-(3-aminopentanoyl)-N-butyl-2,3-dihydroindole-2-carboxamide
Molecular weight317.433
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP1.9
SynonymsBDBM50073050
(S)-1-(3-Amino-pentanoyl)-2,3-dihydro-1H-indole-2-carboxylic acid butylamide
Inchi KeyLRQQXHAERBCTNC-WMCAAGNKSA-N
Inchi IDInChI=1S/C18H27N3O2/c1-3-5-10-20-18(23)16-11-13-8-6-7-9-15(13)21(16)17(22)12-14(19)4-2/h6-9,14,16H,3-5,10-12,19H2,1-2H3,(H,20,23)/t14?,16-/m0/s1
PubChem CID44303372
ChEMBLCHEMBL61498
IUPHARN/A
BindingDB50073050
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
194749Cholecystokinin receptor type AO08786CckarMus musculus (Mouse)436

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