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Ligand

NameCHEMBL2163437
Molecular formulaC35H49N11O6
IUPAC name(2S)-6-amino-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-benzylcarbamoyl]amino]propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]hexanamide
Molecular weight719.848
Hydrogen bond acceptor9
Hydrogen bond donor9
XlogP-0.2
SynonymsBDBM50394992
SCHEMBL19133159
Inchi KeyAHDAGHCWYONEID-KAGDSSDTSA-N
Inchi IDInChI=1S/C35H49N11O6/c1-22(32(49)44-29(17-24-11-5-3-6-12-24)34(51)43-28(30(38)47)15-9-10-16-36)41-31(48)23(2)42-35(52)46(20-25-13-7-4-8-14-25)45-33(50)27(37)18-26-19-39-21-40-26/h3-8,11-14,19,21-23,27-29H,9-10,15-18,20,36-37H2,1-2H3,(H2,38,47)(H,39,40)(H,41,48)(H,42,52)(H,43,51)(H,44,49)(H,45,50)/t22-,23-,27?,28-,29+/m0/s1
PubChem CID60195645
ChEMBLCHEMBL2163437
IUPHARN/A
BindingDB50394992
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
5443Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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