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Ligand

NameCHEMBL452310
Molecular formulaC31H31Cl2N3O5
IUPAC name(2R)-3-[[4-[[4-(cyclohexen-1-yl)-N-[(3,5-dichlorophenyl)carbamoyl]anilino]methyl]benzoyl]amino]-2-methoxypropanoic acid
Molecular weight596.505
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP5.9
SynonymsBDBM50244504
SCHEMBL2665502
(R)-3-{4-[1-(4-Cyclohex-1-enylphenyl)-3-(3,5-dichlorophenyl)ureidomethyl]benzoylamino}-2-methoxypropionic acid
Inchi KeyGIRRFIIUMQOFBL-MUUNZHRXSA-N
Inchi IDInChI=1S/C31H31Cl2N3O5/c1-41-28(30(38)39)18-34-29(37)23-9-7-20(8-10-23)19-36(31(40)35-26-16-24(32)15-25(33)17-26)27-13-11-22(12-14-27)21-5-3-2-4-6-21/h5,7-17,28H,2-4,6,18-19H2,1H3,(H,34,37)(H,35,40)(H,38,39)/t28-/m1/s1
PubChem CID10145290
ChEMBLCHEMBL452310
IUPHARN/A
BindingDB50244504
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
97505Gastric inhibitory polypeptide receptorP48546GIPRHomo sapiens (Human)466
97507Glucagon receptorP47871GCGRHomo sapiens (Human)477
97506Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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