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Name | CHEMBL3891997 |
---|---|
Molecular formula | C26H31F3N2O3 |
IUPAC name | (3S,4S)-1-(2,6-dimethylphenyl)-3-ethyl-4-methyl-5-oxo-N-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide |
Molecular weight | 476.54 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 5.5 |
Synonyms | SCHEMBL12706899 |
Inchi Key | BHJROALXPGZCRF-IQGLISFBSA-N |
Inchi ID | InChI=1S/C26H31F3N2O3/c1-7-25(14-31(23(32)18(25)6)22-16(4)9-8-10-17(22)5)24(33)30-20-11-19(26(27,28)29)12-21(13-20)34-15(2)3/h8-13,15,18H,7,14H2,1-6H3,(H,30,33)/t18-,25-/m1/s1 |
PubChem CID | 51033797 |
ChEMBL | CHEMBL3891997 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
536590 | Chemokine-like receptor 1 | Q99788 | CMKLR1 | Homo sapiens (Human) | 373 |
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