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Ligand

NameMLS000082037
Molecular formulaC24H23N3O4
IUPAC name[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
Molecular weight417.465
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.0
SynonymsZ56903300
AC1M7N7D
HMS2342A03
[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
2-(1-benzimidazolyl)acetic acid [2-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester
[ Show all ]
Inchi KeyDMMIKXQNMAPFBA-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23N3O4/c1-16-12-20(17(2)27(16)18-8-10-19(30-3)11-9-18)23(28)14-31-24(29)13-26-15-25-21-6-4-5-7-22(21)26/h4-12,15H,13-14H2,1-3H3
PubChem CID2421595
ChEMBLCHEMBL1376266
IUPHARN/A
BindingDB37009
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
63830Galanin receptor type 3O60755GALR3Homo sapiens (Human)368
470766Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
63829Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
63828Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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