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Ligand

NameCHEMBL3586033
Molecular formulaC34H38N4O4
IUPAC nameN-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(2,3-dihydro-1-benzofuran-6-ylmethylamino)-5-[(1S,5R)-8-propan-2-yl-8-azabicyclo[3.2.1]oct-2-en-3-yl]pyridine-3-carboxamide
Molecular weight566.702
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.6
SynonymsBDBM50094223
Inchi KeyKEOZUNFWVFOURD-IARZGTGTSA-N
Inchi IDInChI=1S/C34H38N4O4/c1-21(2)38-26-9-10-27(38)15-24(14-26)25-16-29(34(39)37-19-28-20-41-30-5-3-4-6-31(30)42-28)33(36-18-25)35-17-22-7-8-23-11-12-40-32(23)13-22/h3-8,13-14,16,18,21,26-28H,9-12,15,17,19-20H2,1-2H3,(H,35,36)(H,37,39)/t26-,27+,28-/m0/s1
PubChem CID122180027
ChEMBLCHEMBL3586033
IUPHARN/A
BindingDBN/A
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
483618Growth hormone secretagogue receptor type 1O08725GhsrRattus norvegicus (Rat)364
483619Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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