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Ligand

NameCHEMBL3754518
Molecular formulaC26H35N5O6
IUPAC nameN-[(2S)-3-cyclohexyl-1-[[(2S,3S)-3-methyl-1-[(2-nitrophenyl)methylamino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
Molecular weight513.595
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP4.8
SynonymsN/A
Inchi KeyHZTSTAPHCOCFFI-NYDSKATKSA-N
Inchi IDInChI=1S/C26H35N5O6/c1-3-17(2)23(26(34)27-16-19-11-7-8-12-21(19)31(35)36)30-24(32)20(15-18-9-5-4-6-10-18)29-25(33)22-13-14-28-37-22/h7-8,11-14,17-18,20,23H,3-6,9-10,15-16H2,1-2H3,(H,27,34)(H,29,33)(H,30,32)/t17-,20-,23-/m0/s1
PubChem CID56639807
ChEMBLCHEMBL3754518
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
525224Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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