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Name | CHEMBL3733191 |
---|---|
Molecular formula | C28H38BrN3O4 |
IUPAC name | (1R,2R,3R,4S)-3-N-[2-(4-bromophenyl)ethyl]-2-N-(4-pyrrolidin-1-ylbutyl)spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2,3-dicarboxamide;formic acid |
Molecular weight | 560.533 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | None |
Synonyms | N/A |
Inchi Key | BNFZKZYDJKVHGM-NVGWGOIQSA-N |
Inchi ID | InChI=1S/C27H36BrN3O2.CH2O2/c28-20-7-5-19(6-8-20)11-15-30-26(33)24-22-10-9-21(27(22)12-13-27)23(24)25(32)29-14-1-2-16-31-17-3-4-18-31;2-1-3/h5-10,21-24H,1-4,11-18H2,(H,29,32)(H,30,33);1H,(H,2,3)/t21-,22+,23-,24-;/m1./s1 |
PubChem CID | 127024442 |
ChEMBL | CHEMBL3733191 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
522397 | N-formyl peptide receptor 2 | P25090 | FPR2 | Homo sapiens (Human) | 351 |
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