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Ligand

NameCHEMBL1270427
Molecular formulaC29H41N5O4
IUPAC nameN-[(2S)-3-cyclohexyl-1-[[(2S,3S)-3-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
Molecular weight523.678
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.3
SynonymsN/A
Inchi KeyBFBAECDXNIVKOY-CVJWPJSTSA-N
Inchi IDInChI=1S/C29H41N5O4/c1-3-21(2)26(29(37)34-18-16-33(17-19-34)23-12-8-5-9-13-23)32-27(35)24(20-22-10-6-4-7-11-22)31-28(36)25-14-15-30-38-25/h5,8-9,12-15,21-22,24,26H,3-4,6-7,10-11,16-20H2,1-2H3,(H,31,36)(H,32,35)/t21-,24-,26-/m0/s1
PubChem CID49788508
ChEMBLCHEMBL1270427
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
22132Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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