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Name | CHEMBL388007 |
---|---|
Molecular formula | C31H34F6N2O |
IUPAC name | N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-ethyl-3-[(1S,3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentane-1-carboxamide |
Molecular weight | 564.616 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 7.6 |
Synonyms | BDBM50212126 N-{[3,5-bis(trifluoromethyl)phenyl]methyl}-1-ethyl-3-[(1S,5''R)-5''-methylspiro[indene-1,4''-piperidine]-1''-yl]cyclopentane-1-carboxamide |
Inchi Key | FEHOZFOZMBPRSW-FYZPOUGESA-N |
Inchi ID | InChI=1S/C31H34F6N2O/c1-3-28(27(40)38-18-21-14-23(30(32,33)34)16-24(15-21)31(35,36)37)10-9-25(17-28)39-13-12-29(20(2)19-39)11-8-22-6-4-5-7-26(22)29/h4-8,11,14-16,20,25H,3,9-10,12-13,17-19H2,1-2H3,(H,38,40)/t20-,25?,28?,29+/m0/s1 |
PubChem CID | 44425631 |
ChEMBL | CHEMBL388007 |
IUPHAR | N/A |
BindingDB | 50212126 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
76233 | C-C chemokine receptor type 2 | P41597 | CCR2 | Homo sapiens (Human) | 374 |
76234 | C-C chemokine receptor type 2 | P51683 | Ccr2 | Mus musculus (Mouse) | 373 |
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