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Ligand

NamePD165929
Molecular formulaC37H47N5O2
IUPAC name(2S)-2-[[2,6-di(propan-2-yl)phenyl]carbamoylamino]-3-(1H-indol-3-yl)-2-methyl-N-[(1-pyridin-2-ylcyclohexyl)methyl]propanamide
Molecular weight593.816
Hydrogen bond acceptor3
Hydrogen bond donor4
XlogP7.7
SynonymsGTPL620
(2S)-2-[[2,6-di(propan-2-yl)phenyl]carbamoylamino]-3-(1H-indol-3-yl)-2-methyl-N-[(1-pyridin-2-ylcyclohexyl)methyl]propanamide
AC1NSKHB
CHEMBL86828
PD 165929
[ Show all ]
Inchi KeyRVCSRPVACXMJEL-BHVANESWSA-N
Inchi IDInChI=1S/C37H47N5O2/c1-25(2)28-15-13-16-29(26(3)4)33(28)41-35(44)42-36(5,22-27-23-39-31-17-8-7-14-30(27)31)34(43)40-24-37(19-10-6-11-20-37)32-18-9-12-21-38-32/h7-9,12-18,21,23,25-26,39H,6,10-11,19-20,22,24H2,1-5H3,(H,40,43)(H2,41,42,44)/t36-/m0/s1
PubChem CID5311352
ChEMBLCHEMBL86828
IUPHARN/A
BindingDB50071754
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
305921Bombesin receptor subtype-3P32247BRS3Homo sapiens (Human)399
305922Gastrin-releasing peptide receptorP21729GrprMus musculus (Mouse)384
305924Gastrin-releasing peptide receptorP30550GRPRHomo sapiens (Human)384
305923Neuromedin-B receptorP28336NMBRHomo sapiens (Human)390
305925Neuromedin-B receptorP24053NmbrRattus norvegicus (Rat)390

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