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Ligand

NameCHEMBL504245
Molecular formulaC32H31F3N4O5
IUPAC name(2R)-3-[[4-[[N-[[4-cyano-3-(trifluoromethyl)phenyl]carbamoyl]-4-cyclohexylanilino]methyl]benzoyl]amino]-2-hydroxypropanoic acid
Molecular weight608.618
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP5.5
Synonyms(R)-3-{4-[3-(4-Cyano-3-trifluoromethylphenyl)-1-(4-cyclohexylphenyl)ureidomethyl]benzoyl-amino}-2-hydroxypropionic acid
ANMUHQCUTMTNRH-MUUNZHRXSA-N
(R)-3-{4-[3-(4-Cyano-3-trifluoromethylphenyl)-1-(4-cyclohexylphenyl)ureidomethyl]benzoylamino}-2-hydroxypropionic acid
BDBM50245061
SCHEMBL2651818
Inchi KeyANMUHQCUTMTNRH-MUUNZHRXSA-N
Inchi IDInChI=1S/C32H31F3N4O5/c33-32(34,35)27-16-25(13-10-24(27)17-36)38-31(44)39(26-14-11-22(12-15-26)21-4-2-1-3-5-21)19-20-6-8-23(9-7-20)29(41)37-18-28(40)30(42)43/h6-16,21,28,40H,1-5,18-19H2,(H,37,41)(H,38,44)(H,42,43)/t28-/m1/s1
PubChem CID10282370
ChEMBLCHEMBL504245
IUPHARN/A
BindingDB50245061
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9695Gastric inhibitory polypeptide receptorP48546GIPRHomo sapiens (Human)466
9694Glucagon receptorP47871GCGRHomo sapiens (Human)477

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