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Name | CHEMBL604277 |
---|---|
Molecular formula | C26H28N2O4S2 |
IUPAC name | 4-methyl-N-[2-[(4-methylphenyl)sulfonyl-prop-2-enylamino]phenyl]-N-prop-2-enylbenzenesulfonamide |
Molecular weight | 496.64 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 5.4 |
Synonyms | N,N'-Diallyl-N,N'-ditosyl-1,2-benzenediamine BDBM50305737 ZINC2573080 MCULE-3639320640 AC1MQKQY [ Show all ] |
Inchi Key | WLHVFPKZYDQKGS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H28N2O4S2/c1-5-19-27(33(29,30)23-15-11-21(3)12-16-23)25-9-7-8-10-26(25)28(20-6-2)34(31,32)24-17-13-22(4)14-18-24/h5-18H,1-2,19-20H2,3-4H3 |
PubChem CID | 3453336 |
ChEMBL | CHEMBL604277 |
IUPHAR | N/A |
BindingDB | 50305737 |
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 |
---|---|---|---|---|---|
376191 | C-X-C chemokine receptor type 3 | P49682 | CXCR3 | Homo sapiens (Human) | 368 |
376190 | C-X-C chemokine receptor type 4 | P61073 | CXCR4 | Homo sapiens (Human) | 352 |
376188 | C5a anaphylatoxin chemotactic receptor 1 | P21730 | C5AR1 | Homo sapiens (Human) | 350 |
376192 | C5a anaphylatoxin chemotactic receptor 1 | P97520 | C5ar1 | Rattus norvegicus (Rat) | 352 |
376189 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
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