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Ligand

NameCHEMBL317843
Molecular formulaC38H50N10O6
IUPAC nameN-[(5S)-5-[[(2S)-2-acetamido-3-naphthalen-2-ylpropanoyl]amino]-6-[[1-[(2S)-2-carbamoylpyrrolidin-1-yl]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-6-oxohexyl]pyridine-2-carboxamide
Molecular weight742.882
Hydrogen bond acceptor8
Hydrogen bond donor7
XlogP1.0
SynonymsN/A
Inchi KeyAHWPLIOUKUMCQM-IPDPXPSLSA-N
Inchi IDInChI=1S/C38H50N10O6/c1-24(49)45-31(23-25-16-17-26-10-2-3-11-27(26)22-25)36(53)46-29(13-5-7-19-43-34(51)28-12-4-6-18-42-28)35(52)47-30(14-8-20-44-38(40)41)37(54)48-21-9-15-32(48)33(39)50/h2-4,6,10-12,16-18,22,29-32H,5,7-9,13-15,19-21,23H2,1H3,(H2,39,50)(H,43,51)(H,45,49)(H,46,53)(H,47,52)(H4,40,41,44)/t29-,30?,31-,32-/m0/s1
PubChem CID44330385
ChEMBLCHEMBL317843
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5942Gonadotropin-releasing hormone receptorP30969GnrhrRattus norvegicus (Rat)327

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