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Ligand

NameCHEMBL3911013
Molecular formulaC31H38N2O5S
IUPAC name(2R,4S)-2-benzyl-5-[(4-tert-butylphenyl)sulfonylamino]-4-hydroxy-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pentanamide
Molecular weight550.714
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP4.5
SynonymsSCHEMBL17038179
Inchi KeyKIBDBIHYXLJCRO-IIFRUBFJSA-N
Inchi IDInChI=1S/C31H38N2O5S/c1-31(2,3)24-13-15-26(16-14-24)39(37,38)32-20-25(34)18-23(17-21-9-5-4-6-10-21)30(36)33-29-27-12-8-7-11-22(27)19-28(29)35/h4-16,23,25,28-29,32,34-35H,17-20H2,1-3H3,(H,33,36)/t23-,25+,28-,29+/m1/s1
PubChem CID118334829
ChEMBLCHEMBL3911013
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
540339Vasoactive intestinal polypeptide receptor 2P41587VIPR2Homo sapiens (Human)438

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