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Name | CHEMBL3918834 |
---|---|
Molecular formula | C28H33F6N3O2 |
IUPAC name | (3R,4S)-N-[3,5-bis(trifluoromethyl)phenyl]-1-(2,6-dimethylphenyl)-4-methyl-3-[[methyl(2-methylpropyl)amino]methyl]-5-oxopyrrolidine-3-carboxamide |
Molecular weight | 557.581 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 1 |
XlogP | 6.1 |
Synonyms | N/A |
Inchi Key | JIMBXNVWVHOORE-NIYFSFCBSA-N |
Inchi ID | InChI=1S/C28H33F6N3O2/c1-16(2)13-36(6)14-26(15-37(24(38)19(26)5)23-17(3)8-7-9-18(23)4)25(39)35-22-11-20(27(29,30)31)10-21(12-22)28(32,33)34/h7-12,16,19H,13-15H2,1-6H3,(H,35,39)/t19-,26-/m1/s1 |
PubChem CID | 134139127 |
ChEMBL | CHEMBL3918834 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
549822 | Chemokine-like receptor 1 | Q99788 | CMKLR1 | Homo sapiens (Human) | 373 |
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