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Ligand

NameCHEMBL44246
Molecular formulaC27H31N5O3
IUPAC name5-(diaminomethylideneamino)-2-[(2,2-diphenylacetyl)amino]-N-[(4-hydroxyphenyl)methyl]pentanamide
Molecular weight473.577
Hydrogen bond acceptor4
Hydrogen bond donor5
XlogP2.5
SynonymsCAS_5311023
2-Diphenylacetylamino-5-guanidino-pentanoic acid 4-hydroxy-benzylamide
L000127
BDBM50065469
NSC_5311023
[ Show all ]
Inchi KeyKUWBXRGRMQZCSS-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H31N5O3/c28-27(29)30-17-7-12-23(25(34)31-18-19-13-15-22(33)16-14-19)32-26(35)24(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-11,13-16,23-24,33H,7,12,17-18H2,(H,31,34)(H,32,35)(H4,28,29,30)
PubChem CID21129772
ChEMBLCHEMBL44246
IUPHARN/A
BindingDB84996, 50065469
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
556188Neuropeptide FF receptor 2Q9Y5X5NPFFR2Homo sapiens (Human)522
178868Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
178870Neuropeptide Y receptor type 1Q9WVD0NPY1RCavia porcellus (Guinea pig)383
178869Neuropeptide Y receptor type 2Q9Z2D5NPY2RCavia porcellus (Guinea pig)381
178871Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381
178867Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445
556190Neuropeptide Y receptor type 5Q63634Npy5rRattus norvegicus (Rat)445
556189Prolactin-releasing peptide receptorP49683PRLHRHomo sapiens (Human)370

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