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Ligand

NameCHEMBL3754533
Molecular formulaC27H38N4O4
IUPAC nameN-[(2S)-3-cyclohexyl-1-[[(2S,3S)-3-methyl-1-[(2-methylphenyl)methylamino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
Molecular weight482.625
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP5.4
SynonymsN/A
Inchi KeyISWOHFGFOKJXKD-OEOAZWSVSA-N
Inchi IDInChI=1S/C27H38N4O4/c1-4-18(2)24(27(34)28-17-21-13-9-8-10-19(21)3)31-25(32)22(16-20-11-6-5-7-12-20)30-26(33)23-14-15-29-35-23/h8-10,13-15,18,20,22,24H,4-7,11-12,16-17H2,1-3H3,(H,28,34)(H,30,33)(H,31,32)/t18-,22-,24-/m0/s1
PubChem CID56639734
ChEMBLCHEMBL3754533
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
525604Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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