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Ligand

NameCHEMBL3732086
Molecular formulaC20H25BrN4O3
IUPAC name(1R,2R,3R,4S)-2-N-(3-amino-3-oxopropyl)-3-N-[(6-bromopyridin-3-yl)methyl]spiro[bicyclo[2.2.1]heptane-7,1'-cyclopropane]-2,3-dicarboxamide
Molecular weight449.349
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP1.2
SynonymsN/A
Inchi KeyBODXESHAEGUASH-DLTLXFJOSA-N
Inchi IDInChI=1S/C20H25BrN4O3/c21-14-4-1-11(9-24-14)10-25-19(28)17-13-3-2-12(20(13)6-7-20)16(17)18(27)23-8-5-15(22)26/h1,4,9,12-13,16-17H,2-3,5-8,10H2,(H2,22,26)(H,23,27)(H,25,28)/t12-,13+,16-,17-/m1/s1
PubChem CID127036710
ChEMBLCHEMBL3732086
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522414N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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