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Ligand

NameSCHEMBL2682038
Molecular formulaC28H33ClN4O2S
IUPAC name(1R,2R,3R,4S)-3-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-N-(4-pyrrolidin-1-ylbutyl)spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2,3-dicarboxamide
Molecular weight525.108
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.7
SynonymsCHEMBL3732146
Inchi KeyBTXHVXZYPFMNGF-CBJLPSGESA-N
Inchi IDInChI=1S/C28H33ClN4O2S/c29-19-7-5-18(6-8-19)22-17-36-27(31-22)32-26(35)24-21-10-9-20(28(21)11-12-28)23(24)25(34)30-13-1-2-14-33-15-3-4-16-33/h5-10,17,20-21,23-24H,1-4,11-16H2,(H,30,34)(H,31,32,35)/t20-,21+,23-,24-/m1/s1
PubChem CID87421997
ChEMBLCHEMBL3732146
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522530N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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