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Ligand

NameSCHEMBL2683029
Molecular formulaC23H30BrN3O2
IUPAC name(1S,2R,3R,4R)-3-N-(3-amino-2,2-dimethylpropyl)-2-N-[(4-bromophenyl)methyl]spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2,3-dicarboxamide
Molecular weight460.416
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP2.7
SynonymsCHEMBL3728857
Inchi KeyCKYVVFHKUHKNAC-WJFTUGDTSA-N
Inchi IDInChI=1S/C23H30BrN3O2/c1-22(2,12-25)13-27-21(29)19-17-8-7-16(23(17)9-10-23)18(19)20(28)26-11-14-3-5-15(24)6-4-14/h3-8,16-19H,9-13,25H2,1-2H3,(H,26,28)(H,27,29)/t16-,17+,18+,19+/m0/s1
PubChem CID67495766
ChEMBLCHEMBL3728857
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
522822N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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