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Ligand

NameUPCMLD04ASTW002105
Molecular formulaC28H31N3O3
IUPAC namebenzyl N-[(S)-[(1S,2R)-1-methyl-2-[(2R)-1-oxo-1-(pyridin-2-ylmethylamino)propan-2-yl]cyclopropyl]-phenylmethyl]carbamate
Molecular weight457.574
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.3
SynonymsSMR000388807
AC1MMZVN
MLS000563762
MLS003180896
CHEMBL1453137
[ Show all ]
Inchi KeyAHRCPCLEXQYEJS-PFCXFHTISA-N
Inchi IDInChI=1S/C28H31N3O3/c1-20(26(32)30-18-23-15-9-10-16-29-23)24-17-28(24,2)25(22-13-7-4-8-14-22)31-27(33)34-19-21-11-5-3-6-12-21/h3-16,20,24-25H,17-19H2,1-2H3,(H,30,32)(H,31,33)/t20-,24-,25-,28+/m1/s1
PubChem CID3247279
ChEMBLCHEMBL1453137
IUPHARN/A
BindingDBN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5816Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
5815Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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