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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL1271026
Molecular formulaC20H31N3O4
IUPAC nameN-[(2S)-1-[[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]furan-2-carboxamide
Molecular weight377.485
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP3.7
SynonymsN/A
Inchi KeyIZTZUMKMFFRBOX-HOTGVXAUSA-N
Inchi IDInChI=1S/C20H31N3O4/c1-13(2)11-16(23-20(26)17-9-6-10-27-17)19(25)22-15(18(21)24)12-14-7-4-3-5-8-14/h6,9-10,13-16H,3-5,7-8,11-12H2,1-2H3,(H2,21,24)(H,22,25)(H,23,26)/t15-,16-/m0/s1
PubChem CID49788061
ChEMBLCHEMBL1271026
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
145582Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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