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Ligand

NameCHEMBL418898
Molecular formulaC21H20N2O3
IUPAC name(2S)-3-(1H-indol-3-yl)-2-[(2-phenylcyclopropanecarbonyl)amino]propanoic acid
Molecular weight348.402
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP2.3
SynonymsBDBM50287880
D0MS8T
(S)-3-(1H-Indol-3-yl)-2-[(2-phenyl-cyclopropanecarbonyl)-amino]-propionic acid
IRL-1722
Inchi KeyDRPGADQFIJJWNZ-TVPLGVNVSA-N
Inchi IDInChI=1S/C21H20N2O3/c24-20(17-11-16(17)13-6-2-1-3-7-13)23-19(21(25)26)10-14-12-22-18-9-5-4-8-15(14)18/h1-9,12,16-17,19,22H,10-11H2,(H,23,24)(H,25,26)/t16?,17?,19-/m0/s1
PubChem CID9863132
ChEMBLCHEMBL418898
IUPHARN/A
BindingDB50287880
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
67158Endothelin receptor type BP35463EDNRBSus scrofa (Pig)443

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