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Ligand

NameCHEMBL3905722
Molecular formulaC29H34N2O5S
IUPAC name(2R,4S)-2-benzyl-5-[(2,4-dimethylphenyl)sulfonylamino]-4-hydroxy-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pentanamide
Molecular weight522.66
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP3.5
SynonymsSCHEMBL17038200
Inchi KeyGNHUFKXHBGDRAZ-YPTUDWLLSA-N
Inchi IDInChI=1S/C29H34N2O5S/c1-19-12-13-27(20(2)14-19)37(35,36)30-18-24(32)16-23(15-21-8-4-3-5-9-21)29(34)31-28-25-11-7-6-10-22(25)17-26(28)33/h3-14,23-24,26,28,30,32-33H,15-18H2,1-2H3,(H,31,34)/t23-,24+,26-,28+/m1/s1
PubChem CID118334848
ChEMBLCHEMBL3905722
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
538453Vasoactive intestinal polypeptide receptor 2P41587VIPR2Homo sapiens (Human)438

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