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Name | Endothelin receptor type B |
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Species | Oryctolagus cuniculus (Rabbit) |
Gene | EDNRB |
Synonym | Endothelin receptor non-selective type ET-B ET-BR |
Disease | N/A for non-human GPCRs |
Length | 441 |
Amino acid sequence | MQPPPSLCGLALLALVLACGMAEVWGEEREMPSAPATPPLLGASEILTPSTKTSWPRDSNASLPRSSAPAEIPKEGRTAGAPRRTPPPCQRPTEIKDTFKYINTVVSCLVFVLGIIGNSTLLRIIYKNKCMRNGPNILIASLALGDLLHIIIDIPINVYKLLAEDWPFGAEMCKLVPFIQKASVGITVLSLCALSIDRYRAVASWSRIKGIGVPKWTAVEIVLIWVVSVILAVPEAIGFNLVTIDYKGSYLRICLLNPTQKTAFMQFYKTAKDWWLFSFYFCLPLAITAFFYTLMTCEMLRKKSGMQIALNDHLKQRREVAKTVFCLVLVFGLCWLALHLSRILKLTLYDQNDPNRCELLSFLLVLDYIGINMASLNSCINPIALYLVSKRFKNCFKSCLCCWCQSFEEKQSLEEKQSCLKFKANDHGYDNFRSSNKYSSS |
UniProt | Q9N0W7 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL2259248 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL2261361 |
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Molecular formula | C27H26N2O7S |
IUPAC name | (2S)-2-(1,3-benzodioxol-5-yl)-2-[6-(hydroxymethyl)-1-methylindol-3-yl]-N-(2-methoxy-4-methylphenyl)sulfonylacetamide |
Molecular weight | 522.572 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 3.3 |
Synonyms | N-[(S)-2-[1-Methyl-6-(hydroxymethyl)-1H-indole-3-yl]-2-(1,3-benzodioxole-5-yl)acetyl]-2-methoxy-4-methylbenzenesulfonamide |
Inchi Key | PGAMLYVKCIXYNX-SANMLTNESA-N |
Inchi ID | InChI=1S/C27H26N2O7S/c1-16-4-9-25(24(10-16)34-3)37(32,33)28-27(31)26(18-6-8-22-23(12-18)36-15-35-22)20-13-29(2)21-11-17(14-30)5-7-19(20)21/h4-13,26,30H,14-15H2,1-3H3,(H,28,31)/t26-/m0/s1 |
PubChem CID | 76312118 |
ChEMBL | CHEMBL2261361 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Kb | 1600.0 nM | Med Chem Res, (2004) 13:3:149 | ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417