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Ligand

NameSCHEMBL2681433
Molecular formulaC23H29BrN2O3
IUPAC name(1R,2R,3R,4S)-3-N-[(4-bromophenyl)methyl]-2-N-(3-ethoxypropyl)spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2,3-dicarboxamide
Molecular weight461.4
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.0
SynonymsCHEMBL3729806
Inchi KeyBFLIBBIGXHZPOB-IYWMVGAKSA-N
Inchi IDInChI=1S/C23H29BrN2O3/c1-2-29-13-3-12-25-21(27)19-17-8-9-18(23(17)10-11-23)20(19)22(28)26-14-15-4-6-16(24)7-5-15/h4-9,17-20H,2-3,10-14H2,1H3,(H,25,27)(H,26,28)/t17-,18+,19-,20-/m1/s1
PubChem CID67494972
ChEMBLCHEMBL3729806
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
522222N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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