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Ligand

NameCHEMBL410825
Molecular formulaC24H40N4O3
IUPAC name(2S)-2-acetamido-N-[(3S)-1-[[4-[3-(dimethylamino)propoxy]phenyl]methyl]pyrrolidin-3-yl]-4-methylpentanamide
Molecular weight432.609
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.7
SynonymsN/A
Inchi KeyCWVDSPSUXSWOOC-GMAHTHKFSA-N
Inchi IDInChI=1S/C24H40N4O3/c1-18(2)15-23(25-19(3)29)24(30)26-21-11-13-28(17-21)16-20-7-9-22(10-8-20)31-14-6-12-27(4)5/h7-10,18,21,23H,6,11-17H2,1-5H3,(H,25,29)(H,26,30)/t21-,23-/m0/s1
PubChem CID44399083
ChEMBLCHEMBL410825
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
52456Urotensin-2 receptorQ9UKP6UTS2RHomo sapiens (Human)389

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