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Name | C-C chemokine receptor type 6 |
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Species | Homo sapiens (Human) |
Gene | CCR6 |
Synonym | DRY6 G-protein coupled receptor 29 GPR-CY4 GPR29 GPRCY4 [ Show all ] |
Disease | N/A |
Length | 374 |
Amino acid sequence | MSGESMNFSDVFDSSEDYFVSVNTSYYSVDSEMLLCSLQEVRQFSRLFVPIAYSLICVFGLLGNILVVITFAFYKKARSMTDVYLLNMAIADILFVLTLPFWAVSHATGAWVFSNATCKLLKGIYAINFNCGMLLLTCISMDRYIAIVQATKSFRLRSRTLPRSKIICLVVWGLSVIISSSTFVFNQKYNTQGSDVCEPKYQTVSEPIRWKLLMLGLELLFGFFIPLMFMIFCYTFIVKTLVQAQNSKRHKAIRVIIAVVLVFLACQIPHNMVLLVTAANLGKMNRSCQSEKLIGYTKTVTEVLAFLHCCLNPVLYAFIGQKFRNYFLKILKDLWCVRRKYKSSGFSCAGRYSENISRQTSETADNDNASSFTM |
UniProt | P51684 |
Protein Data Bank | N/A |
GPCR-HGmod model | P51684 |
3D structure model | This predicted structure model is from GPCR-EXP P51684. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL4423 |
IUPHAR | N/A |
DrugBank | N/A |
Name | MLS000662068 |
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Molecular formula | C16H15NO7S2 |
IUPAC name | benzyl 2-(4-methylsulfonyl-2-nitrophenyl)sulfinylacetate |
Molecular weight | 397.416 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 0 |
XlogP | 1.6 |
Synonyms | 2-(4-methylsulfonyl-2-nitrophenyl)sulfinylacetic acid (phenylmethyl) ester SMR000292712 BDBM68106 HMS2595L16 ST50142808 [ Show all ] |
Inchi Key | HOPVGZYLIFZCOP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H15NO7S2/c1-26(22,23)13-7-8-15(14(9-13)17(19)20)25(21)11-16(18)24-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3 |
PubChem CID | 1189521 |
ChEMBL | CHEMBL1341008 |
IUPHAR | N/A |
BindingDB | 68106 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 17100.0 nM | , PubChem BioAssay data set | BindingDB,ChEMBL |
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