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Name | SCHEMBL17056275 |
---|---|
Molecular formula | C18H21ClIN |
IUPAC name | 4-chloro-N-ethyl-N-[1-(3-iodo-2-methylphenyl)ethyl]-3-methylaniline |
Molecular weight | 413.727 |
Hydrogen bond acceptor | 1 |
Hydrogen bond donor | 0 |
XlogP | 6.3 |
Synonyms | BDBM264704 US9718771, 3-4 |
Inchi Key | ACHIEEOICYQEGD-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H21ClIN/c1-5-21(15-9-10-17(19)12(2)11-15)14(4)16-7-6-8-18(20)13(16)3/h6-11,14H,5H2,1-4H3 |
PubChem CID | 118349186 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 264704 |
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 |
---|---|---|---|---|---|
557345 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
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