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Ligand

NameCHEMBL3099779
Molecular formulaC25H24N4O3
IUPAC name(2S)-4-methyl-2-[(2-phenyl-1-quinolin-4-ylimidazole-4-carbonyl)amino]pentanoic acid
Molecular weight428.492
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.5
SynonymsBDBM50444954
MLS-0437327.0001
Inchi KeyBVSRWZIQRFETGU-FQEVSTJZSA-N
Inchi IDInChI=1S/C25H24N4O3/c1-16(2)14-20(25(31)32)28-24(30)21-15-29(23(27-21)17-8-4-3-5-9-17)22-12-13-26-19-11-7-6-10-18(19)22/h3-13,15-16,20H,14H2,1-2H3,(H,28,30)(H,31,32)/t20-/m0/s1
PubChem CID49837907
ChEMBLCHEMBL3099779
IUPHARN/A
BindingDB50444954
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34035Neurotensin receptor type 1P30989NTSR1Homo sapiens (Human)418

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