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Ligand

NameCHEMBL3912591
Molecular formulaC28H33N3O5S
IUPAC name(2R,4S)-2-benzyl-4-hydroxy-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5-[[4-(methylamino)phenyl]sulfonylamino]pentanamide
Molecular weight523.648
Hydrogen bond acceptor7
Hydrogen bond donor5
XlogP2.8
SynonymsSCHEMBL17038242
Inchi KeyBKYWRNZKMUENOX-JWRZUHOQSA-N
Inchi IDInChI=1S/C28H33N3O5S/c1-29-22-11-13-24(14-12-22)37(35,36)30-18-23(32)16-21(15-19-7-3-2-4-8-19)28(34)31-27-25-10-6-5-9-20(25)17-26(27)33/h2-14,21,23,26-27,29-30,32-33H,15-18H2,1H3,(H,31,34)/t21-,23+,26-,27+/m1/s1
PubChem CID118334890
ChEMBLCHEMBL3912591
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
536681Vasoactive intestinal polypeptide receptor 2P41587VIPR2Homo sapiens (Human)438

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