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Ligand

NameCHEMBL3729027
Molecular formulaC28H38FN3O5
IUPAC name(1R,2R,3R,4S)-3-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-N-(4-pyrrolidin-1-ylbutyl)spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2,3-dicarboxamide;formic acid
Molecular weight515.626
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyBSKLOKOSBSIJBH-ZBIVHNQWSA-N
Inchi IDInChI=1S/C27H36FN3O3.CH2O2/c1-34-22-9-6-18(16-21(22)28)17-30-26(33)24-20-8-7-19(27(20)10-11-27)23(24)25(32)29-12-2-3-13-31-14-4-5-15-31;2-1-3/h6-9,16,19-20,23-24H,2-5,10-15,17H2,1H3,(H,29,32)(H,30,33);1H,(H,2,3)/t19-,20+,23-,24-;/m1./s1
PubChem CID127024635
ChEMBLCHEMBL3729027
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522508N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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